KEGG   DRUG: LisavanbulinHelp
Entry
D11494                      Drug                                   

Name
Lisavanbulin (USAN/INN)
Formula
C26H29N9O3
Exact mass
515.2393
Mol weight
515.567
Structure
Mol fileKCF fileDB search
Efficacy
Antineoplastic, Tubulin polymerization inhibitor
Target
  Pathway
hsa04540  Gap junction
Brite
Target-based classification of drugs [BR:br08310]
 Not elsewhere classified
  Cellular process
   Cytoskeleton
    TUBB
     D11494  Lisavanbulin (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 1263384-43-5
PubChem: 384585470
ChEMBL: CHEMBL4297595
LinkDB All DBs
KCF data Show

ATOM        38
            1   C8x C    13.5501  -26.7738
            2   C8x C    12.9179  -25.5796
            3   C8x C    11.5130  -25.5796
            4   C8x C    10.8106  -26.7035
            5   C8y C    11.4428  -27.9679
            6   C8y C    12.8476  -27.9679
            7   N5x N    10.9511  -29.3025
            8   C8y C    12.0750  -30.1454
            9   N4y N    13.2691  -29.3025
            10  C8y C    12.0750  -31.5503
            11  C1b C    14.4632  -30.0049
            12  C5a C    15.6574  -29.3025
            13  C8y C    16.8515  -30.0049
            14  O5a O    15.6574  -27.8976
            15  C8x C    16.8515  -31.4098
            16  C8x C    18.1159  -32.1122
            17  C8y C    19.3100  -31.4098
            18  C8x C    19.3100  -30.0049
            19  C8x C    18.1159  -29.3025
            20  C8y C    10.9511  -32.3932
            21  N5x N    11.3725  -33.7278
            22  O2x O    12.7774  -33.7278
            23  N5x N    13.1989  -32.3932
            24  N1b N     9.7570  -31.6908
            25  C1b C     8.5628  -32.3932
            26  C1b C     7.3687  -31.6908
            27  C3b C     6.1746  -32.3932
            28  N3a N     4.9102  -33.0956
            29  N1b N    20.5041  -32.1122
            30  C5a C    21.7189  -31.4240
            31  C1c C    22.9140  -32.1272
            32  C1b C    24.1127  -31.4481
            33  C1b C    25.2872  -32.1390
            34  C1b C    26.4960  -31.4541
            35  C1b C    27.7168  -32.1726
            36  O5a O    21.7303  -30.0303
            37  N1a N    22.9026  -33.5299
            38  N1a N    28.9257  -31.4884
BOND        41
            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     5   7 1
            8     7   8 2
            9     8   9 1
            10    6   9 1
            11    8  10 1
            12   11   9 1
            13   11  12 1
            14   12  13 1
            15   12  14 2
            16   13  15 2
            17   15  16 1
            18   16  17 2
            19   17  18 1
            20   18  19 2
            21   13  19 1
            22   10  20 1
            23   20  21 2
            24   21  22 1
            25   22  23 1
            26   10  23 2
            27   20  24 1
            28   24  25 1
            29   25  26 1
            30   26  27 1
            31   27  28 3
            32   17  29 1
            33   29  30 1
            34   30  31 1
            35   31  32 1
            36   32  33 1
            37   33  34 1
            38   34  35 1
            39   30  36 2
            40   31  37 1 #Down
            41   35  38 1

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