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canSAR1969686
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NAMES
    SMILES
    Cc1ccc(CNc2nc(NCc3ccccc3)nc3ccsc23)c(C)c1
    InChI
    InChI=1S/C22H22N4S/c1-15-8-9-18(16(2)12-15)14-23-21-20-19(10-11-27-20)25-22(26-21)24-13-17-6-4-3-5-7-17/h3-12H,13-14H2,1-2H3,(H2,23,24,25,26)
    MOLECULAR FORMULA
    C22H22N4S
    CROSS REFERENCES
    1969686 logo

    canSAR1969686

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 374.16
    AlogP 5.53
    HBond donors 2
    HBond acceptors 4
    Atoms 49
    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 canSAR1969686.