KEGG   DRUG: GalunisertibHelp
Entry
D10437                      Drug                                   

Name
Galunisertib (USAN)
Formula
C22H19N5O
Exact mass
369.159
Mol weight
369.4192
Structure
Mol fileKCF fileDB search
Efficacy
Antineoplastic
Target
TGFBR1 [HSA:7046] [KO:K04674]
  Pathway
hsa04350  TGF-beta signaling pathway
hsa05200  Pathways in cancer
Brite
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Receptor serine/threonine kinases (RSTK)
   TGFBR1 family
    TGFBR1
     D10437  Galunisertib (USAN)
BRITE hierarchy
Other DBs
CAS: 700874-72-2
PubChem: 172232530
ChEBI: 137064
ChEMBL: CHEMBL2364611
LinkDB All DBs
KCF data Show

ATOM        28
            1   C8x C    10.0100  -14.7000
            2   C8y C    10.0100  -16.1000
            3   C8x C    11.2224  -16.8000
            4   C8y C    12.4349  -16.1000
            5   C8y C    12.4349  -14.7000
            6   C8x C    11.2224  -14.0000
            7   C8y C    13.6473  -16.8000
            8   C8x C    14.8597  -16.1000
            9   C8x C    14.8597  -14.7000
            10  N5x N    13.6473  -14.0000
            11  C5a C     8.7976  -16.8000
            12  N1a N     7.6021  -16.1096
            13  O5a O     8.7975  -18.1998
            14  C8y C    13.6473  -18.2000
            15  C8y C    12.5164  -19.0216
            16  N4y N    12.9484  -20.3510
            17  N5x N    14.3462  -20.3510
            18  C8y C    14.7782  -19.0216
            19  C1x C    11.1186  -19.0216
            20  C1x C    10.6866  -20.3511
            21  C1x C    11.8175  -21.1727
            22  C8y C    16.0968  -18.5933
            23  N5x N    17.1522  -19.5435
            24  C8y C    18.4837  -19.1107
            25  C8x C    18.7747  -17.7413
            26  C8x C    17.7192  -16.7912
            27  C8x C    16.3878  -17.2239
            28  C1a C    19.5218  -20.0453
BOND        32
            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     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    5  10 1
            12    2  11 1
            13   11  12 1
            14   11  13 2
            15    7  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 1
            19   17  18 2
            20   14  18 1
            21   15  19 1
            22   19  20 1
            23   20  21 1
            24   16  21 1
            25   18  22 1
            26   22  23 2
            27   23  24 1
            28   24  25 2
            29   25  26 1
            30   26  27 2
            31   22  27 1
            32   24  28 1

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