KEGG   DRUG: NazartinibHelp
Entry
D11430                      Drug                                   

Name
Nazartinib (USAN/INN)
Formula
C26H31ClN6O2
Exact mass
494.2197
Mol weight
495.0163
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Remark
Chemical structure group: DG03015
Efficacy
Antineoplastic, Receptor tyrosine kinase inhibitor
Target
EGFR [HSA:1956] [KO:K04361]
  Pathway
hsa04010  MAPK signaling pathway
hsa04012  ErbB signaling pathway
hsa05200  Pathways in cancer
Brite
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Receptor tyrosine kinases (RTK)
   EGFR family
    EGFR
     D11430  Nazartinib (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 1508250-71-2
PubChem: 384585407
ChEMBL: CHEMBL3787344
LinkDB All DBs
KCF data Show

ATOM        35
            1   C8x C    20.0900  -17.9200
            2   C8x C    20.0900  -19.3200
            3   C8x C    18.9000  -20.0200
            4   C8y C    17.6400  -19.3200
            5   C8y C    17.6400  -17.9200
            6   C8y C    18.9000  -17.2200
            7   N5x N    16.3100  -19.7400
            8   C8y C    15.5400  -18.6200
            9   N4y N    16.3100  -17.5000
            10  N1b N    14.1400  -18.6200
            11  C5a C    13.4400  -19.8100
            12  C8y C    12.0400  -19.8100
            13  O5a O    14.1400  -21.0000
            14  C8x C    11.3400  -21.0000
            15  C8y C     9.9400  -21.0000
            16  N5x N     9.2400  -19.8100
            17  C8x C     9.9400  -18.6200
            18  C8x C    11.3400  -18.6200
            19  C1a C     9.2400  -22.1900
            20  X   Cl   18.9000  -15.8200
            21  C1y C    15.8900  -16.1700
            22  C1x C    17.0100  -13.9300
            23  C1x C    15.8900  -13.0200
            24  C1x C    14.5600  -13.3700
            25  N1y N    13.9300  -14.6300
            26  C1x C    17.0100  -15.3300
            27  C1x C    14.5600  -15.8900
            28  C5a C    12.7400  -15.3300
            29  C2b C    11.5500  -14.6300
            30  O5a O    12.7400  -16.7300
            31  C2b C    10.3600  -15.3300
            32  C1b C     9.1700  -14.6300
            33  N1c N     7.9800  -15.3300
            34  C1a C     6.7900  -14.6300
            35  C1a C     7.9800  -16.7300
BOND        38
            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    5   9 1
            11    8  10 1
            12   10  11 1
            13   11  12 1
            14   11  13 2
            15   12  14 2
            16   14  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   12  18 1
            21   15  19 1
            22    6  20 1
            23   21   9 1 #Up
            24   24  25 1
            25   22  26 1
            26   25  27 1
            27   23  24 1
            28   26  21 1
            29   22  23 1
            30   27  21 1
            31   25  28 1
            32   28  29 1
            33   28  30 2
            34   29  31 2
            35   31  32 1
            36   32  33 1
            37   33  34 1
            38   33  35 1

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