KEGG   DRUG: SecnidazoleHelp
Entry
D07353                      Drug                                   

Name
Secnidazole (USAN/INN);
Secnidal (TN);
Solosec (TN)
Product
Formula
C7H11N3O3
Exact mass
185.08
Mol weight
185.1805
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antiparasitic
 DG01884  Imidazole antiprotozoal
Remark
ATC code: P01AB07
Product: D07353<US>
Efficacy
Amebicide, Antiprotozoal
  Disease
Bacterial vaginosis [DS:H01380]
Comment
Nitroimidazole derivative
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 P ANTIPARASITIC PRODUCTS, INSECTICIDES AND REPELLENTS
  P01 ANTIPROTOZOALS
   P01A AGENTS AGAINST AMOEBIASIS AND OTHER PROTOZOAL DISEASES
    P01AB Nitroimidazole derivatives
     P01AB07 Secnidazole
      D07353  Secnidazole (USAN/INN) <US>
New drug approvals in the USA [br08319.html]
 New Molecular Entity and New Therapeutic Biological Product Approvals
  D07353
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D07353
BRITE hierarchy
Other DBs
CAS: 3366-95-8
PubChem: 51091690
ChEBI: 140628
ChEMBL: CHEMBL498847
LigandBox: D07353
NIKKAJI: J7.723B
LinkDB All DBs
KCF data Show

ATOM        13
            1   N4y N    23.5200  -17.2200
            2   C8y C    23.1000  -18.4800
            3   C8y C    22.4700  -16.4500
            4   C1b C    24.5700  -16.5900
            5   C8x C    21.7700  -18.4800
            6   N2b N    23.8700  -19.6000 #+
            7   N5x N    21.3500  -17.2200
            8   C1a C    22.4700  -15.1200
            9   C1c C    25.6900  -17.2900
            10  O3a O    25.0600  -20.7200
            11  O3a O    22.4700  -20.7200 #-
            12  O1a O    26.9500  -16.5900
            13  C1a C    25.6900  -18.6900
BOND        13
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     6  10 2
            10    6  11 1
            11    9  12 1
            12    5   7 1
            13    9  13 1

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