KEGG   DRUG: MepacrineHelp
Entry
D08179                      Drug                                   

Name
Mepacrine (INN);
Quinacrin
Formula
C23H30ClN3O
Exact mass
399.2077
Mol weight
399.9568
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Same as: C07339
ATC code: P01AX05
Chemical structure group: DG01012
Efficacy
Antimalarial, Antiprotozoal
Comment
Acridine derivative
Structure map
map07025  Quinolines
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 P ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
  P01 ANTIPROTOZOALS
   P01A AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
    P01AX Other agents against amoebiasis and other protozoal diseases
     P01AX05 Mepacrine
      D08179  Mepacrine (INN)
BRITE hierarchy
Other DBs
CAS: 83-89-6
PubChem: 96024869
ChEBI: 8711
ChEMBL: CHEMBL7568
DrugBank: DB01103
LigandBox: D08179
NIKKAJI: J3.877F
LinkDB All DBs
KCF data Show

ATOM        28
            1   C8x C    18.7600  -19.3200
            2   C8y C    18.7600  -20.7900
            3   C8x C    19.9500  -21.4900
            4   C8y C    21.1400  -20.7900
            5   C8y C    21.1400  -19.3200
            6   C8x C    19.9500  -18.6200
            7   N5x N    22.4000  -21.4900
            8   C8y C    23.5900  -20.7900
            9   C8y C    23.5900  -19.3200
            10  C8y C    22.4000  -18.6200
            11  C8x C    24.7800  -21.4900
            12  C8x C    26.0400  -20.7900
            13  C8y C    26.0400  -19.3200
            14  C8x C    24.7800  -18.6200
            15  X   Cl   17.5000  -21.4900
            16  O2a O    27.2300  -18.6200
            17  C1a C    28.4900  -19.3200
            18  N1b N    22.4000  -17.2200
            19  C1c C    23.5900  -16.5200
            20  C1b C    24.7800  -17.2200
            21  C1a C    23.5900  -15.1200
            22  C1b C    25.9700  -16.5200
            23  C1b C    27.1600  -17.2200
            24  N1c N    28.3500  -16.5200
            25  C1b C    29.6100  -17.2200
            26  C1b C    28.3500  -15.1200
            27  C1a C    29.6100  -14.4200
            28  C1a C    30.8000  -16.5200
BOND        30
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    8  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16    9  14 1
            17    2  15 1
            18   13  16 1
            19   16  17 1
            20   10  18 1
            21   18  19 1
            22   19  20 1
            23   19  21 1
            24   20  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   24  26 1
            29   26  27 1
            30   25  28 1

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