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canSAR1687888
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NAMES
    SMILES
    COC(=O)c1c(/N=C/N(C)C)sc2c1CCN(c1ncc(C(F)(F)F)cc1Cl)C2
    InChI
    InChI=1S/C18H18ClF3N4O2S/c1-25(2)9-24-16-14(17(27)28-3)11-4-5-26(8-13(11)29-16)15-12(19)6-10(7-23-15)18(20,21)22/h6-7,9H,4-5,8H2,1-3H3/b24-9+
    MOLECULAR FORMULA
    C18H18ClF3N4O2S
    CROSS REFERENCES
    1687888 logo

    canSAR1687888

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.08
    AlogP 4.39
    HBond donors 0
    HBond acceptors 6
    Atoms 47
    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 canSAR1687888.