PDB ligand accession: 9M2
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: CGEINWMYWNHNPM-UHFFFAOYSA-N
SMILES: Cc1c(c(n(n1)C)C)CCOc2cc(ccc2c3ccc4c(c3)c([nH]n4)CN(C)C)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrazoles
- Subclass: Indazoles
- Class: Benzopyrazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6TW5 | Download | Experimental | e6tw5AAA1 e6tw5AAA2 e6tw5BBB1 e6tw5BBB2 e6tw5CCC1 e6tw5CCC2 | Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy Nat/Ivy | LigPlot |