canSAR856535
FEATURES
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NAMES
    SMILES
    CO[C@@H]1[C@H](O[P@@](=O)(NCCCCCC(=O)[O-])OC[C@@H]2C[C@@H](O)[C@H](n3ccc(N)nc3=O)O2)[C@@H](COP(=O)([O-])[O-])O[C@H]1n1cnc2c(=O)[nH]c(N)nc21.[Na+].[Na+].[Na+]
    InChI
    InChI=1S/C26H39N9O15P2.3Na/c1-45-20-19(15(11-47-52(42,43)44)49-24(20)35-12-29-18-21(35)32-25(28)33-22(18)39)50-51(41,30-7-4-2-3-5-17(37)38)46-10-13-9-14(36)23(48-13)34-8-6-16(27)31-26(34)40;;;/h6,8,12-15,19-20,23-24,36H,2-5,7,9-11H2,1H3,(H,30,41)(H,37,38)(H2,27,31,40)(H2,42,43,44)(H3,28,32,33,39);;;/q;3*+1/p-3/t13-,14+,15+,19+,20+,23+,24+,51+;;;/m0.../s1
    MOLECULAR FORMULA
    C26H36N9Na3O15P2
    CROSS REFERENCES
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    canSAR856535
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight845.15
    AlogP-12.63
    HBond donors7
    HBond acceptors24
    Atoms91
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR856535.