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canSAR1715086
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NAMES
    SMILES
    O=C(CC1SC(N2CCCCC2)=NC1=O)Nc1cccc(C(=O)N2CCCC(C(F)(F)F)C2)c1
    InChI
    InChI=1S/C23H27F3N4O3S/c24-23(25,26)16-7-5-11-30(14-16)21(33)15-6-4-8-17(12-15)27-19(31)13-18-20(32)28-22(34-18)29-9-2-1-3-10-29/h4,6,8,12,16,18H,1-3,5,7,9-11,13-14H2,(H,27,31)
    MOLECULAR FORMULA
    C23H27F3N4O3S
    CROSS REFERENCES
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    canSAR1715086

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 496.18
    AlogP 3.91
    HBond donors 1
    HBond acceptors 7
    Atoms 61
    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 canSAR1715086.