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canSAR468101
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NAMES
    SMILES
    C/C(=N/OC(=O)c1ccc(F)cc1)N1N=C(c2ccc(Cl)cc2Cl)CC1c1ccc(C(F)(F)F)cc1
    InChI
    InChI=1S/C25H17Cl2F4N3O2/c1-14(33-36-24(35)16-4-9-19(28)10-5-16)34-23(15-2-6-17(7-3-15)25(29,30)31)13-22(32-34)20-11-8-18(26)12-21(20)27/h2-12,23H,13H2,1H3/b33-14-
    MOLECULAR FORMULA
    C25H17Cl2F4N3O2
    CROSS REFERENCES
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    canSAR468101

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 537.06
    AlogP 7.49
    HBond donors 0
    HBond acceptors 5
    Atoms 53
    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 canSAR468101.