KEGG   COMPOUND: C07568Help
Entry
C07568                      Compound                               

Name
Ziprasidone
Formula
C21H21ClN4OS
Exact mass
412.1125
Mol weight
412.9356
Structure
Mol fileKCF fileDB search
Remark
Same as: D08687
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05A ANTIPSYCHOTICS
    N05AE Indole derivatives
     N05AE04 Ziprasidone
      D08687  Ziprasidone (INN)
USP drug classification [BR:br08302]
 Antipsychotics
  2nd Generation/Atypical
   Ziprasidone
    D08687  Ziprasidone (INN)
 Bipolar Agents
  Bipolar Agents, Other
   Ziprasidone
    D08687  Ziprasidone (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    DRD2
     D08687  Ziprasidone (INN)
   Serotonin
    HTR2A
     D08687  Ziprasidone (INN)
BRITE hierarchy
Other DBs
CAS: 146939-27-7
PubChem: 9771
ChEBI: 10119
ChEMBL: CHEMBL708
NIKKAJI: J553.147K
LinkDB All DBs
KCF data Show

ATOM        28
            1   C8y C    19.6787  -15.8391
            2   C8y C    18.4160  -16.4120
            3   N1y N    20.8831  -16.5173
            4   N5x N    19.6496  -14.4243
            5   C8y C    17.4807  -15.3656
            6   C8x C    17.9950  -17.7508
            7   C1x C    20.8306  -17.9321
            8   C1x C    22.1050  -15.7981
            9   S2x S    18.1705  -14.1554
            10  C8x C    16.1126  -15.6462
            11  C8x C    16.6447  -18.0372
            12  C1x C    22.1225  -18.6043
            13  C1x C    23.2975  -16.4996
            14  C8x C    15.6742  -17.0142
            15  N1y N    23.3209  -17.9027
            16  C1b C    24.5369  -18.5809
            17  C1b C    25.6770  -17.8910
            18  C8y C    26.8695  -18.5458
            19  C8x C    28.0855  -17.9027
            20  C8y C    26.8695  -19.9548
            21  C8y C    29.3073  -18.5809
            22  C8x C    28.0855  -20.6681
            23  X   Cl   25.6653  -20.6562
            24  C8y C    29.3016  -19.9840
            25  C1x C    30.6462  -18.1542
            26  N1x N    30.6345  -20.4284
            27  C5x C    31.4705  -19.2941
            28  O5x O    32.8619  -19.3058
BOND        32
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13   10  14 2
            14   12  15 1
            15   15  16 1
            16   16  17 1
            17   17  18 1
            18   18  19 2
            19   18  20 1
            20   19  21 1
            21   20  22 2
            22   20  23 1
            23   21  24 2
            24   21  25 1
            25   24  26 1
            26   25  27 1
            27   27  28 2
            28    5   9 1
            29   11  14 1
            30   13  15 1
            31   22  24 1
            32   26  27 1

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