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canSAR1828346
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NAMES
    SMILES
    CNc1ccc2c(c1)NC(=O)CCc1nc(ccc1F)CC(NC(=O)/C=C/c1cc(Cl)ccc1-n1cnnn1)c1nc-2c(Cl)[nH]1
    InChI
    InChI=1S/C30H25Cl2FN10O2/c1-34-18-4-6-20-23(13-18)37-27(45)11-8-22-21(33)7-5-19(36-22)14-24(30-39-28(20)29(32)40-30)38-26(44)10-2-16-12-17(31)3-9-25(16)43-15-35-41-42-43/h2-7,9-10,12-13,15,24,34H,8,11,14H2,1H3,(H,37,45)(H,38,44)(H,39,40)/b10-2+
    MOLECULAR FORMULA
    C30H25Cl2FN10O2
    CROSS REFERENCES
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    canSAR1828346

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 646.15
    AlogP 4.93
    HBond donors 4
    HBond acceptors 12
    Atoms 70
    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 canSAR1828346.