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canSAR1017849
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NAMES
    SMILES
    CN1CCC(CNc2cc(Nc3cc(C4CC4)[nH]n3)nc(-c3ccccc3)n2)CC1
    InChI
    InChI=1S/C23H29N7/c1-30-11-9-16(10-12-30)15-24-20-14-21(25-22-13-19(28-29-22)17-7-8-17)27-23(26-20)18-5-3-2-4-6-18/h2-6,13-14,16-17H,7-12,15H2,1H3,(H3,24,25,26,27,28,29)
    MOLECULAR FORMULA
    C23H29N7
    CROSS REFERENCES
    1017849 logo

    canSAR1017849

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.25
    AlogP 4.24
    HBond donors 3
    HBond acceptors 7
    Atoms 59
    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 canSAR1017849.