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canSAR1068863
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NAMES
    SMILES
    O[C@@H]1Cc2ccccc2[C@@H]1n1cnc2c(Cl)ncnc21
    InChI
    InChI=1S/C14H11ClN4O/c15-13-11-14(17-6-16-13)19(7-18-11)12-9-4-2-1-3-8(9)5-10(12)20/h1-4,6-7,10,12,20H,5H2/t10-,12+/m1/s1
    MOLECULAR FORMULA
    C14H11ClN4O
    CROSS REFERENCES
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    canSAR1068863

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 286.06
    AlogP 1.99
    HBond donors 1
    HBond acceptors 5
    Atoms 31
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1068863.