PDB ligand accession: HBT
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: OBHKTNMETRQPKN-VIFPVBQESA-N
SMILES: CC1CCc2c(sc(c2C(=O)N)NC(=O)c3ccccc3[N+](=O)[O-])C1
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Nitrobenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3HMV | Download | Experimental | e3hmvA1 e3hmvB1 | PDEase-like PDEase-like | LigPlot |