PDB ligand accession: 3N6
DrugBank: DB04869
PubChem:
ChEMBL:
InChI Key: ITIXDWVDFFXNEG-JHOUSYSJSA-N
SMILES: NCCCC[C@H](NC(=O)[C@@H](CC1=CC(Br)=C(O)C(Br)=C1)NC(=O)N1CCC(CC1)N1CC2=C(NC1=O)C=CC=C2)C(=O)N1CCN(CC1)C1=CC=NC=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
ASN | 123 | N-linked_glycosylation |