KEGG   DRUG: Omecamtiv mecarbilHelp
Entry
D09648                      Drug                                   

Name
Omecamtiv mecarbil (USAN/INN)
Formula
C20H24FN5O3
Exact mass
401.1863
Mol weight
401.4347
Structure
Mol fileKCF fileDB search
Efficacy
Cardiotonic, Myosin activator
Comment
Treatment of heart failure, a cardiac inotrope
Other DBs
CAS: 873697-71-3
PubChem: 124490388
ChEMBL: CHEMBL1800955
PDB-CCD: 2OW[PDBj]
LigandBox: D09648
LinkDB All DBs
KCF data Show

ATOM        29
            1   C8y C    30.2400  -25.5500
            2   C8x C    30.2400  -24.1500
            3   C8x C    29.0500  -23.4500
            4   C8y C    27.7900  -24.1500
            5   C8x C    27.7900  -25.5500
            6   N5x N    29.0500  -26.2500
            7   N1b N    26.6000  -23.4500
            8   C5a C    25.4100  -24.1500
            9   N1b N    24.2200  -23.4500
            10  O5a O    25.4100  -25.5500
            11  C8y C    23.0300  -24.1500
            12  C8y C    21.8400  -23.4500
            13  C8y C    20.5800  -24.1500
            14  C8x C    20.5800  -25.5500
            15  C8x C    21.7700  -26.2500
            16  C8x C    23.0300  -25.5500
            17  X   F    21.8400  -22.0500
            18  C1a C    31.4300  -26.2500
            19  C1b C    19.3900  -23.4500
            20  N1y N    18.2000  -24.1500
            21  C1x C    17.0100  -23.4500
            22  C1x C    15.7500  -24.1500
            23  N1y N    15.7500  -25.5500
            24  C1x C    16.9400  -26.2500
            25  C1x C    18.2000  -25.5500
            26  C7a C    14.5600  -26.2500
            27  O7a O    13.3700  -25.5500
            28  O6a O    14.5600  -27.6500
            29  C1a C    12.1800  -26.2500
BOND        31
            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 1
            9     8   9 1
            10    8  10 2
            11    9  11 1
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   11  16 2
            18   12  17 1
            19    1  18 1
            20   13  19 1
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   23  24 1
            26   24  25 1
            27   20  25 1
            28   23  26 1
            29   26  27 1
            30   26  28 2
            31   27  29 1

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