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canSAR1590065
FEATURES
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NAMES
    SMILES
    N#CC1=C(SCC(=O)Nc2ccccc2)NC(=O)CC1c1ccco1
    InChI
    InChI=1S/C18H15N3O3S/c19-10-14-13(15-7-4-8-24-15)9-16(22)21-18(14)25-11-17(23)20-12-5-2-1-3-6-12/h1-8,13H,9,11H2,(H,20,23)(H,21,22)
    MOLECULAR FORMULA
    C18H15N3O3S
    CROSS REFERENCES
    1590065 logo

    canSAR1590065

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.08
    AlogP 2.99
    HBond donors 2
    HBond acceptors 6
    Atoms 40
    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 canSAR1590065.