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canSAR993000
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NAMES
    SMILES
    N#C/C(=C\c1cccc(C(=O)NC2CC2)c1)C(=O)NC1CC1
    InChI
    InChI=1S/C17H17N3O2/c18-10-13(17(22)20-15-6-7-15)9-11-2-1-3-12(8-11)16(21)19-14-4-5-14/h1-3,8-9,14-15H,4-7H2,(H,19,21)(H,20,22)/b13-9+
    MOLECULAR FORMULA
    C17H17N3O2
    CROSS REFERENCES
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    canSAR993000

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 295.13
    AlogP 1.76
    HBond donors 2
    HBond acceptors 5
    Atoms 39
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR993000.