KEGG   DRUG: Molindone
Entry
D08226                      Drug                                   

Name
Molindone (INN)
Formula
C16H24N2O2
Exact mass
276.1838
Mol weight
276.374
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01478  Dopamine antagonist
  DG01474  Dopamine D2-receptor antagonist
Remark
Same as: C07230
ATC code: N05AE02
Chemical structure group: DG00891
Product (DG00891): D00796<US>
Efficacy
Antipsychotic, Dopamine D2 receptor antagonist
Target
DRD2 [HSA:1813] [KO:K04145]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04728  Dopaminergic synapse
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05A ANTIPSYCHOTICS
    N05AE Indole derivatives
     N05AE02 Molindone
      D08226  Molindone (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    DRD2
     D08226  Molindone (INN)
Other DBs
CAS: 7416-34-4
PubChem: 96024914
ChEBI: 6965
ChEMBL: CHEMBL460
DrugBank: DB01618
LigandBox: D08226
NIKKAJI: J8.932J
LinkDB
KCF data

ATOM        20
            1   C8y C    22.3300  -17.9200
            2   C8y C    22.3300  -16.5200
            3   C8y C    21.0000  -18.3400
            4   C5x C    23.5200  -18.6200
            5   N4x N    21.0000  -16.1000
            6   C1x C    23.5200  -15.8200
            7   C8y C    20.1600  -17.2200
            8   C1b C    20.5800  -19.6700
            9   C1y C    24.7100  -17.9200
            10  O5x O    23.5200  -20.0200
            11  C1x C    24.7100  -16.5200
            12  C1a C    18.7600  -17.2200
            13  C1a C    19.1800  -20.0200
            14  C1b C    25.9700  -18.6200
            15  N1y N    27.1600  -17.9200
            16  C1x C    28.3500  -18.6200
            17  C1x C    27.1600  -16.5200
            18  C1x C    29.6100  -17.9200
            19  C1x C    28.3500  -15.8200
            20  O2x O    29.6100  -16.5200
BOND        22
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     4  10 2
            10    6  11 1
            11    7  12 1
            12    8  13 1
            13    9  14 1
            14   14  15 1
            15   15  16 1
            16   15  17 1
            17   16  18 1
            18   17  19 1
            19   18  20 1
            20    5   7 1
            21    9  11 1
            22   19  20 1

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