Centanafadine

Highest phase reached
Drug type
Small molecule

Listing at source
Listed
Highest phase reached

Drug type
Small molecule
Drug name
Centanafadine
Molecular weight
Structure (SMILES)
c1ccc2cc([C@]34CNC[C@H]3C4)ccc2c1

  • centanafadina
  • Centanafadina
  • centanafadine
  • Centanafadine
  • centanafadine [INN]
  • CENTANAFADINE [USAN]
  • Centanafadine [WHO-DD]
  • centanafadine inn
  • centanafadine usan
  • centanafadine who dd
  • CENTANAFADINE, (+)-
  • dov 216 419
  • dov 216 419 free base
  • DOV 216,419
  • DOV 216,419 free base
  • dov 216419
  • DOV-216419
  • eb 1020
  • eb 1020 free base
  • EB-1020
  • EB-1020 free base

CAS registry numbers
  • 924012-43-1
ChEMBL ID
CHEMBL3301621
InChIKey
HKHCSWPSUSWGLI-CABCVRRESA-N
PubChem compound IDs
  • 16095349
FDA ingredient codes (UNII)
  • D2A6T4UH9C

First in class
No
Orphan designation
No

Pharmacology name
centanafadine
Type
Synthetic organic
Drug name stem
-fadine
Approval recorded by Guide to Pharmacology
Yes

  • Action
    Inhibition
    Action type
    Inhibitor
    Target
    NET
    Gene symbol
    SLC6A2
    Protein identifier
    P23975
    Median affinity
    8
    Affinity units
    pIC50
  • Action
    Inhibition
    Action type
    Inhibitor
    Target
    SERT
    Gene symbol
    SLC6A4
    Protein identifier
    P31645
    Median affinity
    7.05
    Affinity units
    pIC50
  • Action
    Inhibition
    Action type
    Inhibitor
    Target
    DAT
    Gene symbol
    SLC6A3
    Protein identifier
    Q01959
    Median affinity
    7.22
    Affinity units
    pIC50
  • Mechanism
    Monoamine transporter inhibitor
    Action type
    Inhibitor
    Target
    Monoamine transporter
    Protein identifier
    P23975
  • Mechanism
    Monoamine transporter inhibitor
    Action type
    Inhibitor
    Target
    Monoamine transporter
    Protein identifier
    P31645
  • Mechanism
    Monoamine transporter inhibitor
    Action type
    Inhibitor
    Target
    Monoamine transporter
    Protein identifier
    Q01959

Open Targets mechanisms

  • Mechanism
    Monoamine transporter inhibitor
    Action type
    Inhibitor
    Target
    Monoamine transporter

  • Condition
    Attention Deficit Disorder with Hyperactivity
    Highest recorded phase
    3
    Condition identifier
    EFO:0003888
    Subject identifier
    D001289
  • Condition
    Smoking Cessation
    Highest recorded phase
    2
    Condition identifier
    EFO:0004319
    Subject identifier
    D016540
  • Condition
    Feeding and Eating Disorders
    Highest recorded phase
    2
    Condition identifier
    EFO:0005203
    Subject identifier
    D001068
  • Condition
    Depressive Disorder, Major
    Highest recorded phase
    2
    Condition identifier
    MONDO:0002009
    Subject identifier
    D003865

  • Condition identifier
    EFO_0003888
    Highest recorded phase
    3
  • Condition identifier
    EFO_0004319
    Highest recorded phase
    2
  • Condition identifier
    EFO_0005203
    Highest recorded phase
    2
  • Condition identifier
    HP_0000739
    Highest recorded phase
    3
  • Condition identifier
    MONDO_0002009
    Highest recorded phase
    2
  • Condition identifier
    MONDO_0005582
    Highest recorded phase
    2
  • Condition identifier
    MONDO_0007743
    Highest recorded phase
    3
  • Condition identifier
    MONDO_0011918
    Highest recorded phase
    3

Hydrogen bond acceptors
1
Hydrogen bond donors
1
Polar surface area
12.03
Calculated partition coefficient (ALogP)
2.7
Calculated partition coefficient (XLogP)
3
Prodrug
No
Chirality
Single enantiomer
Inorganic
No
Rule-of-five violations
0
Rotatable bonds
1
Heavy atoms
16
Molecular formula
C15H15N
Monoisotopic mass
209.120449483
Natural product
No

Recorded assays
6
Active assays
2

Active assay types

  • Confirmatory

Related records

Trials (21)

In development for (5)

Targets (3)