KEGG   DRUG: Endralazine mesylateHelp
Entry
D03994                      Drug                                   

Name
Endralazine mesylate (USAN);
Endralazine monomethanesulfonate;
Migranal (TN)
Formula
C14H15N5O. CH4SO3
Exact mass
365.1158
Mol weight
365.4075
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG02046  Hydrazinophthalazine derivative
Remark
ATC code: C02DB03
Chemical structure group: DG00262
Efficacy
Antihypertensive
Comment
Hydrazinophthalazine derivative
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 C CARDIOVASCULAR SYSTEM
  C02 ANTIHYPERTENSIVES
   C02D ARTERIOLAR SMOOTH MUSCLE, AGENTS ACTING ON
    C02DB Hydrazinophthalazine derivatives
     C02DB03 Endralazine
      D03994  Endralazine mesylate (USAN)
BRITE hierarchy
Other DBs
CAS: 65322-72-7
PubChem: 47205975
ChEMBL: CHEMBL1980706
LigandBox: D03994
KCF data Show

ATOM        25
            1   C8x C     3.9900  -13.5100
            2   C8x C     3.9900  -14.9100
            3   C8x C     5.2024  -15.6100
            4   C8x C     6.4149  -14.9100
            5   C8y C     6.4149  -13.5100
            6   C8x C     5.2024  -12.8100
            7   C1x C     8.8397  -14.9100
            8   N1y N     8.8397  -13.5100
            9   C5a C     7.6273  -12.8100
            10  C1x C    10.0522  -15.6100
            11  C8y C    11.2646  -14.9100
            12  C8y C    11.2646  -13.5100
            13  C1x C    10.0522  -12.8100
            14  O5a O     7.6273  -11.4100
            15  N5x N    12.4770  -15.6100
            16  N4x N    13.6895  -14.9100
            17  C8y C    13.6895  -13.5100
            18  C8x C    12.4770  -12.8100
            19  N2b N    14.9246  -12.7966
            20  N1a N    16.1319  -13.4934
            21  S4a S    21.6278  -14.3023
            22  C1a C    20.2279  -14.3023
            23  O1d O    23.0277  -14.3023
            24  O1d O    21.6278  -12.9024
            25  O1d O    21.6278  -15.7023
BOND        26
            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 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14    8  13 1
            15    9  14 2
            16   11  15 2
            17   15  16 1
            18   16  17 1
            19   17  18 1
            20   12  18 2
            21   17  19 2
            22   19  20 1
            23   21  22 1
            24   21  23 1
            25   21  24 2
            26   21  25 2

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