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canSAR1018480
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NAMES
    SMILES
    Nc1ccc2cn([C@H]3C[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C3)c3ncnc(n1)c23
    InChI
    InChI=1S/C14H18N5O10P3/c15-11-2-1-9-5-19(14-12(9)13(18-11)16-7-17-14)10-3-8(4-10)6-27-31(23,24)29-32(25,26)28-30(20,21)22/h1-2,5,7-8,10H,3-4,6H2,(H,23,24)(H,25,26)(H2,20,21,22)(H2,15,16,17,18)/t8-,10+
    MOLECULAR FORMULA
    C14H18N5O10P3
    CROSS REFERENCES
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    canSAR1018480

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 509.03
    AlogP 1.86
    HBond donors 6
    HBond acceptors 15
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1018480.