PDB ligand accession: NZT
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BNGHGURIVRPDJB-UHFFFAOYSA-N
SMILES: c1cc2cccnc2c(c1)S(=O)(=O)Nc3ccc(cc3)C(=O)N4CCN(CC4)c5cnccn5
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 |
---|---|---|---|---|---|
4G1N | Download | Experimental | e4g1nA2 e4g1nA3 e4g1nB2 e4g1nD2 e4g1nD3 e4g1nC2 e4g1nC3 | TIM beta/alpha-barrel PK C-terminal domain-like TIM beta/alpha-barrel PK C-terminal domain-like TIM beta/alpha-barrel TIM beta/alpha-barrel PK C-terminal domain-like | LigPlot |