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canSAR1060076
FEATURES
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NAMES
    SMILES
    CCCCC#Cc1nc2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
    InChI
    InChI=1S/C16H21N5O4/c1-2-3-4-5-6-10-20-11-14(17)18-8-19-15(11)21(10)16-13(24)12(23)9(7-22)25-16/h8-9,12-13,16,22-24H,2-4,7H2,1H3,(H2,17,18,19)/t9-,12-,13-,16-/m1/s1
    MOLECULAR FORMULA
    C16H21N5O4
    CROSS REFERENCES
    1060076 logo

    canSAR1060076

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 347.16
    AlogP -0.44
    HBond donors 5
    HBond acceptors 9
    Atoms 46
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1060076.