PDB ligand accession: 347
DrugBank: DB07013
PubChem:
ChEMBL:
InChI Key: RXFCFGLSOUOCEA-UHFFFAOYSA-N
SMILES: CC#CCNc1ccc(cc1)S(=O)(=O)CC2(CCN(CC2)C(=O)OC(C)(C)C)C(=O)NO
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Aniline and substituted anilines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2PJT | Download | Experimental | e2pjtA1 e2pjtB1 e2pjtC1 e2pjtD1 | Zincin-like Zincin-like Zincin-like Zincin-like | LigPlot |