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canSAR653986
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NAMES
    SMILES
    O=C(CCCCCCOc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1)NO
    InChI
    InChI=1S/C21H22ClFN4O3/c22-17-11-14(6-8-18(17)23)26-21-16-12-15(7-9-19(16)24-13-25-21)30-10-4-2-1-3-5-20(28)27-29/h6-9,11-13,29H,1-5,10H2,(H,27,28)(H,24,25,26)
    MOLECULAR FORMULA
    C21H22ClFN4O3
    CROSS REFERENCES
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    canSAR653986

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 432.14
    AlogP 5.00
    HBond donors 3
    HBond acceptors 7
    Atoms 52
    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 canSAR653986.