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canSAR1716753
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NAMES
    SMILES
    COC1(c2ncc(Cl)cc2C)CCCN(C(=O)c2cn(C)nc2N)C1
    InChI
    InChI=1S/C17H22ClN5O2/c1-11-7-12(18)8-20-14(11)17(25-3)5-4-6-23(10-17)16(24)13-9-22(2)21-15(13)19/h7-9H,4-6,10H2,1-3H3,(H2,19,21)
    MOLECULAR FORMULA
    C17H22ClN5O2
    CROSS REFERENCES
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    canSAR1716753

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 363.15
    AlogP 2.14
    HBond donors 2
    HBond acceptors 7
    Atoms 47
    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 canSAR1716753.