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canSAR1636262
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NAMES
    SMILES
    C=C(C)Cc1c(C)c(C#N)c2nc3ccccc3n2c1NCCCN(C)C
    InChI
    InChI=1S/C22H27N5/c1-15(2)13-17-16(3)18(14-23)22-25-19-9-6-7-10-20(19)27(22)21(17)24-11-8-12-26(4)5/h6-7,9-10,24H,1,8,11-13H2,2-5H3
    MOLECULAR FORMULA
    C22H27N5
    CROSS REFERENCES
    1636262 logo

    canSAR1636262

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.23
    AlogP 4.15
    HBond donors 1
    HBond acceptors 5
    Atoms 54
    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 canSAR1636262.