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Attributes

UniProt ID
Protein Name
Nitric oxide synthase 3
Ligand Name
4-(2-{5-[2-(dimethylamino)ethyl]-2,3-difluorophenyl}ethyl)-6-methylpyrimidin-2-amine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VWQYXRPMXXUGAZ-UHFFFAOYSA-N
SMILES
Cc1cc(nc(n1)N)CCc2cc(cc(c2F)F)CCN(C)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 8FGQ
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Color Legend
Unassigned regionsLigand / hetero atomse8fgqA1e8fgqB1e8fgqC1e8fgqD1
ECOD domains from experimental PDB structures interacting with ligand V80
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P29474n/aV808fgqe8fgqA1A:68-480
P29474n/aV808fgqe8fgqB1B:67-480
P29474n/aV808fgqe8fgqC1C:67-480
P29474n/aV808fgqe8fgqD1D:68-480