KEGG   COMPOUND: C20266
Entry
C20266                      Compound                               

Name
AMD 070
Formula
C21H27N5
Exact mass
349.2266
Mol weight
349.4726
Structure
Remark
Same as: D11510
Pathway
map07053  Anti-HIV agents
Brite
Target-based classification of compounds [BR:br08010]
 G Protein-coupled receptors
  Rhodopsin family: peptide receptors
   CXC Chemokine
    C-X-C chemokine receptor type 4
     C20266  AMD 070
Target-based classification of drugs [BR:br08310]
 Cytokines and receptors
  Cytokine receptors
   Chemokine receptors
    CXCR4 (CD184)
     D11510  Mavorixafor (USAN)
Other DBs
CAS: 558447-26-0
PubChem: 163312006
ChEBI: 138865
ChEMBL: CHEMBL518924
KCF data

ATOM        26
            1   C1b C    28.7700  -11.4100
            2   C1b C    29.9600  -12.1100
            3   N1a N    31.1500  -11.4100
            4   C1b C    27.5800  -12.1100
            5   C1b C    26.3900  -11.4100
            6   N1c N    25.2000  -12.1100
            7   C1b C    24.0100  -11.4100
            8   C1y C    25.2000  -13.5100
            9   C8y C    22.8200  -12.1100
            10  N4x N    21.5600  -11.5500
            11  C8y C    20.6500  -12.6000
            12  C8y C    21.2800  -13.7900
            13  N5x N    22.6800  -13.4400
            14  C8x C    19.2500  -12.6000
            15  C8x C    18.5500  -13.7900
            16  C8x C    19.1800  -14.9800
            17  C8x C    20.5800  -14.9800
            18  C1x C    24.0100  -14.2100
            19  C1x C    24.0100  -15.6100
            20  C1x C    25.2000  -16.3100
            21  C8y C    26.3900  -15.6100
            22  C8y C    26.3900  -14.2100
            23  C8x C    27.6024  -16.3100
            24  C8x C    28.8149  -15.6100
            25  C8x C    28.8149  -14.2100
            26  N5x N    27.6024  -13.5100
BOND        29
            1     1   2 1
            2     2   3 1
            3     1   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     8   6 1 #Down
            8     7   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12   12  13 1
            13    9  13 2
            14   11  14 2
            15   14  15 1
            16   15  16 2
            17   16  17 1
            18   12  17 2
            19    8  18 1
            20   18  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24    8  22 1
            25   21  23 2
            26   23  24 1
            27   24  25 2
            28   25  26 1
            29   22  26 2

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