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canSAR1206195
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NAMES
    SMILES
    COc1cc(C(F)(F)F)cc(SC)c1C(=O)NC1(c2cnccn2)CCCN(C)C1
    InChI
    InChI=1S/C20H23F3N4O2S/c1-27-8-4-5-19(12-27,16-11-24-6-7-25-16)26-18(28)17-14(29-2)9-13(20(21,22)23)10-15(17)30-3/h6-7,9-11H,4-5,8,12H2,1-3H3,(H,26,28)
    MOLECULAR FORMULA
    C20H23F3N4O2S
    CROSS REFERENCES
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    canSAR1206195

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.15
    AlogP 3.58
    HBond donors 1
    HBond acceptors 6
    Atoms 53
    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 canSAR1206195.