PDB ligand accession: 778
DrugBank: DB07227
InChI Key: JNUGFGAVPBYSHF-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)Cl)N2CCN(CC2=O)Cc3cncn3Cc4ccc(cc4)C#N
Drug action: modulator
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazinanes
- Subclass: Piperazines
- Class: Diazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P53609 | Download | Predicted | P53609_F1_nD1 | Repetitive alpha hairpins |