PDB ligand accession: 88E
DrugBank: DB16881
PubChem:
ChEMBL:
InChI Key: DGPGXHRHNRYVDH-UHFFFAOYSA-N
SMILES: Cc1cc(nn1c2ccc3ccccc3c2)OCCN4CCOCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: None
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7W2D | Download | Experimental | e7w2dA1 e7w2dC1 e7w2dE1 e7w2dB1 e7w2dD1 e7w2dF1 e7w2dG1 e7w2dH1 e7w2dI1 e7w2dJ1 e7w2dK1 e7w2dL1 | jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |
7W2H | Download | Experimental | e7w2hA1 e7w2hC1 e7w2hE1 e7w2hB1 e7w2hD1 e7w2hF1 e7w2hG1 e7w2hH1 e7w2hI1 e7w2hJ1 e7w2hK1 e7w2hL1 e7w2hM1 e7w2hN1 e7w2hO1 e7w2hP1 e7w2hQ1 e7w2hR1 e7w2hS1 e7w2hT1 e7w2hU1 e7w2hV1 e7w2hW1 e7w2hX1 | jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |