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canSAR1207269
FEATURES
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NAMES
    SMILES
    CNc1ncnc2c1nc(SCc1ccccc1)n2[C@@H]1O[C@@H]2COP(=O)(O)O[C@H]2[C@H]1O
    InChI
    InChI=1S/C18H20N5O6PS/c1-19-15-12-16(21-9-20-15)23(18(22-12)31-8-10-5-3-2-4-6-10)17-13(24)14-11(28-17)7-27-30(25,26)29-14/h2-6,9,11,13-14,17,24H,7-8H2,1H3,(H,25,26)(H,19,20,21)/t11-,13-,14-,17-/m1/s1
    MOLECULAR FORMULA
    C18H20N5O6PS
    CROSS REFERENCES
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    canSAR1207269

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 465.09
    AlogP 1.93
    HBond donors 3
    HBond acceptors 11
    Atoms 51
    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 canSAR1207269.