KEGG   DRUG: DiclazurilHelp
Entry
D03794                      Drug                                   

Name
Diclazuril (USAN/INN)
Formula
C17H9Cl3N4O2
Exact mass
405.9791
Mol weight
407.638
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Efficacy
Coccidiostat (for poultry)
Other DBs
CAS: 101831-37-2
PubChem: 17397882
ChEMBL: CHEMBL284733
LigandBox: D03794
LinkDB All DBs
KCF data Show

ATOM        26
            1   C8x C    26.1781  -15.0458
            2   C8y C    26.1781  -16.4455
            3   C8x C    27.3902  -17.1454
            4   C8x C    28.6025  -16.4455
            5   C8y C    28.6025  -15.0458
            6   C8x C    27.3902  -14.3460
            7   C8y C    31.0267  -16.4455
            8   C8y C    31.0267  -15.0458
            9   C1c C    29.8146  -14.3460
            10  C8x C    32.2390  -17.1454
            11  C8y C    33.4511  -16.4455
            12  C8x C    33.4511  -15.0458
            13  C8y C    32.2390  -14.3460
            14  C3b C    29.8146  -12.9463
            15  N3a N    29.8146  -11.5465
            16  X   Cl   24.9659  -17.1454
            17  X   Cl   29.7999  -17.1540
            18  X   Cl   32.2390  -12.9466
            19  N4y N    34.6722  -17.1505
            20  C8y C    34.6722  -18.5498
            21  N4x N    35.8846  -19.2498
            22  C8y C    37.0970  -18.5498
            23  C8x C    37.0970  -17.1505
            24  N5x N    35.8846  -16.4505
            25  O5x O    38.3118  -19.2512
            26  O5x O    33.4431  -19.2596
BOND        28
            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     7   8 1
            8     8   9 1
            9     5   9 1
            10    7  10 2
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14    8  13 2
            15    9  14 1
            16   14  15 3
            17    2  16 1
            18    7  17 1
            19   13  18 1
            20   11  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   23  24 2
            26   19  24 1
            27   22  25 2
            28   20  26 2

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