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canSAR1445924
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NAMES
    SMILES
    COc1ccccc1-c1ccnc(-n2ncc(C(=O)NC(C)(C)CO)c2C2CC2)n1
    InChI
    InChI=1S/C22H25N5O3/c1-22(2,13-28)26-20(29)16-12-24-27(19(16)14-8-9-14)21-23-11-10-17(25-21)15-6-4-5-7-18(15)30-3/h4-7,10-12,14,28H,8-9,13H2,1-3H3,(H,26,29)
    MOLECULAR FORMULA
    C22H25N5O3
    CROSS REFERENCES
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    canSAR1445924

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 407.20
    AlogP 2.72
    HBond donors 2
    HBond acceptors 8
    Atoms 55
    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 canSAR1445924.