PDB ligand accession: LND
DrugBank: n/a
PubChem: 76314587;118024428;136224222;136951133;
ChEMBL:
InChI Key: AEYBMKVDFNSVJO-UHFFFAOYSA-O
SMILES: c1c[n+](ccc1C(=O)N)CCCn2ccnc2C=NO
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyridinecarboxylic acids and derivatives
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6O5R | Download | Experimental | e6o5rA1 e6o5rB1 | alpha/beta-Hydrolases alpha/beta-Hydrolases | LigPlot |
6O5S | Download | Experimental | e6o5sA1 e6o5sB1 | alpha/beta-Hydrolases alpha/beta-Hydrolases | LigPlot |
8DT5 | Download | Experimental | e8dt5A1 e8dt5B1 | alpha/beta-Hydrolases alpha/beta-Hydrolases | LigPlot |
6O5V | Download | Experimental | e6o5vA1 e6o5vB1 | alpha/beta-Hydrolases alpha/beta-Hydrolases | LigPlot |
6O66 | Download | Experimental | e6o66A1 e6o66B1 | alpha/beta-Hydrolases alpha/beta-Hydrolases | LigPlot |