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canSAR1769422
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NAMES
    SMILES
    Cc1cccc(N=C(S)NC2CCCCC2)n1
    InChI
    InChI=1S/C13H19N3S/c1-10-6-5-9-12(14-10)16-13(17)15-11-7-3-2-4-8-11/h5-6,9,11H,2-4,7-8H2,1H3,(H2,14,15,16,17)
    MOLECULAR FORMULA
    C13H19N3S
    CROSS REFERENCES
    1769422 logo

    canSAR1769422

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 249.13
    AlogP 3.23
    HBond donors 1
    HBond acceptors 3
    Atoms 36
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1769422.