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canSAR1768105
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NAMES
    SMILES
    O=C(Nc1ccccc1)c1cccc(N2CCc3nc(CS)ncc3C2)n1
    InChI
    InChI=1S/C20H19N5OS/c26-20(22-15-5-2-1-3-6-15)17-7-4-8-19(24-17)25-10-9-16-14(12-25)11-21-18(13-27)23-16/h1-8,11,27H,9-10,12-13H2,(H,22,26)
    MOLECULAR FORMULA
    C20H19N5OS
    CROSS REFERENCES
    1768105 logo

    canSAR1768105

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 377.13
    AlogP 3.12
    HBond donors 1
    HBond acceptors 6
    Atoms 46
    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 canSAR1768105.