KEGG   DRUG: Metoprine
Entry
D00309                      Drug                                   

Name
Metoprine (USAN)
Formula
C11H10Cl2N4
Exact mass
268.0283
Mol weight
269.1299
Structure
Simcomp
Efficacy
Antineoplastic
Other DBs
CAS: 7761-45-7
PubChem: 7847375
ChEMBL: CHEMBL264373
PDB-CCD: C2M[PDBj]
LigandBox: D00309
NIKKAJI: J9.654G
LinkDB
KCF data

ATOM        17
            1   C8y C    24.8034  -17.2230
            2   C8y C    23.5827  -16.5385
            3   C8y C    23.5656  -15.1383
            4   N5x N    24.7692  -14.4227
            5   C8y C    26.0598  -15.1072
            6   N5x N    26.0069  -16.5073
            7   N1a N    27.1933  -14.3915
            8   C1a C    24.7505  -18.6231
            9   N1a N    22.3449  -14.4539
            10  C8y C    22.3792  -17.2541
            11  C8x C    22.4196  -18.6543
            12  C8x C    21.1461  -19.3699
            13  C8y C    19.9254  -18.6855
            14  C8y C    19.9549  -17.2853
            15  C8x C    21.1586  -16.5697
            16  X   Cl   18.7343  -16.6009
            17  X   Cl   18.7219  -19.4011
BOND        18
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     5   7 1
            8     1   8 1
            9     3   9 1
            10    2  10 1
            11   10  11 1
            12   11  12 2
            13   12  13 1
            14   13  14 2
            15   14  15 1
            16   10  15 2
            17   14  16 1
            18   13  17 1

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