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canSAR1691371
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NAMES
    SMILES
    N#Cc1c(NCCN)nc(-c2ccccc2)c2c1CCCC2
    InChI
    InChI=1S/C18H20N4/c19-10-11-21-18-16(12-20)14-8-4-5-9-15(14)17(22-18)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-11,19H2,(H,21,22)
    MOLECULAR FORMULA
    C18H20N4
    CROSS REFERENCES
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    canSAR1691371

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 292.17
    AlogP 2.87
    HBond donors 3
    HBond acceptors 4
    Atoms 42
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1691371.