BDBM50661662 Centanafadina::Centanafadine::DOV 216,419::DOV 216,419 free base::DOV-216419::EB-1020::EB-1020 free base

SMILES c1ccc2cc(ccc2c1)[C@@]34C[C@@H]3CNC4

InChI Key InChIKey=HKHCSWPSUSWGLI-UHFFFAOYSA-N

Data  3 IC50

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50661662   

TargetSodium-dependent noradrenaline transporter(Human)
Chinese Academy of Sciences

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50661662BDBM50661662(Centanafadine | Centanafadina | DOV 216,419 | DOV ...)
Affinity DataIC50: 10nMAssay Description:Inhibition of human NETMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed
TargetSodium-dependent dopamine transporter(Human)
Chinese Academy of Sciences

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50661662BDBM50661662(Centanafadine | Centanafadina | DOV 216,419 | DOV ...)
Affinity DataIC50: 60nMAssay Description:Inhibition of DAT (unknown origin)More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetSodium-dependent serotonin transporter(Human)
Chinese Academy of Sciences

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50661662BDBM50661662(Centanafadine | Centanafadina | DOV 216,419 | DOV ...)
Affinity DataIC50: 9.00E+4nMAssay Description:Inhibition of human SERTMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
6/5/2026
Entry Details
PubMed