canSAR1648244
FEATURES
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NAMES
    SMILES
    S=C(Nc1ccccc1Oc1ccccc1)NC1CCCC1
    InChI
    InChI=1S/C18H20N2OS/c22-18(19-14-8-4-5-9-14)20-16-12-6-7-13-17(16)21-15-10-2-1-3-11-15/h1-3,6-7,10-14H,4-5,8-9H2,(H2,19,20,22)
    MOLECULAR FORMULA
    C18H20N2OS
    CROSS REFERENCES
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    canSAR1648244
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight312.13
    AlogP4.71
    HBond donors2
    HBond acceptors3
    Atoms42
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1648244.