canSAR1847013
FEATURES
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NAMES
    SMILES
    Cc1ccc2cc(C#N)c(N3CCN(C(=O)c4ccccc4)CC3)nc2c1
    InChI
    InChI=1S/C22H20N4O/c1-16-7-8-18-14-19(15-23)21(24-20(18)13-16)25-9-11-26(12-10-25)22(27)17-5-3-2-4-6-17/h2-8,13-14H,9-12H2,1H3
    MOLECULAR FORMULA
    C22H20N4O
    CROSS REFERENCES
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    canSAR1847013
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight356.16
    AlogP3.38
    HBond donors0
    HBond acceptors5
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1847013.