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canSAR1528098
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NAMES
    SMILES
    CCCN1CCC2(CC1)C(C#N)=C(N)Oc1c2sc2nc(C)cc(C)c12
    InChI
    InChI=1S/C20H24N4OS/c1-4-7-24-8-5-20(6-9-24)14(11-21)18(22)25-16-15-12(2)10-13(3)23-19(15)26-17(16)20/h10H,4-9,22H2,1-3H3
    MOLECULAR FORMULA
    C20H24N4OS
    CROSS REFERENCES
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    canSAR1528098

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 368.17
    AlogP 3.74
    HBond donors 2
    HBond acceptors 5
    Atoms 50
    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 canSAR1528098.