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canSAR847732
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NAMES
    SMILES
    NC(=S)NN=C1C2CCCC1C(c1ccc(F)cc1)NC2c1ccc(F)cc1
    InChI
    InChI=1S/C21H22F2N4S/c22-14-8-4-12(5-9-14)18-16-2-1-3-17(20(16)26-27-21(24)28)19(25-18)13-6-10-15(23)11-7-13/h4-11,16-19,25H,1-3H2,(H3,24,27,28)
    MOLECULAR FORMULA
    C21H22F2N4S
    CROSS REFERENCES
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    canSAR847732

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.15
    AlogP 3.96
    HBond donors 4
    HBond acceptors 4
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR847732.