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canSAR545732
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NAMES
    SMILES
    N#Cc1ccc2[nH]cc(CN3CCC4(CC3)CN(CCNCc3ccccc3)C(=O)O4)c2c1
    InChI
    InChI=1S/C26H29N5O2/c27-15-21-6-7-24-23(14-21)22(17-29-24)18-30-11-8-26(9-12-30)19-31(25(32)33-26)13-10-28-16-20-4-2-1-3-5-20/h1-7,14,17,28-29H,8-13,16,18-19H2
    MOLECULAR FORMULA
    C26H29N5O2
    CROSS REFERENCES
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    canSAR545732

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.23
    AlogP 3.62
    HBond donors 2
    HBond acceptors 7
    Atoms 62
    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 canSAR545732.