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canSAR1976613
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NAMES
    SMILES
    Clc1ccc(OCc2ccccc2)nc1-c1ccnc2[nH]c(C3CCNCC3)cc12
    InChI
    InChI=1S/C24H23ClN4O/c25-20-6-7-22(30-15-16-4-2-1-3-5-16)29-23(20)18-10-13-27-24-19(18)14-21(28-24)17-8-11-26-12-9-17/h1-7,10,13-14,17,26H,8-9,11-12,15H2,(H,27,28)
    MOLECULAR FORMULA
    C24H23ClN4O
    CROSS REFERENCES
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    canSAR1976613

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.16
    AlogP 5.32
    HBond donors 2
    HBond acceptors 5
    Atoms 53
    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 canSAR1976613.