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canSAR1619896
FEATURES
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NAMES
    SMILES
    COc1ccc(NC(=O)Cn2nnc(-c3ccccc3)c2COc2ccc(C(C)=O)cc2)cn1
    InChI
    InChI=1S/C25H23N5O4/c1-17(31)18-8-11-21(12-9-18)34-16-22-25(19-6-4-3-5-7-19)28-29-30(22)15-23(32)27-20-10-13-24(33-2)26-14-20/h3-14H,15-16H2,1-2H3,(H,27,32)
    MOLECULAR FORMULA
    C25H23N5O4
    CROSS REFERENCES
    1619896 logo

    canSAR1619896

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 457.18
    AlogP 3.77
    HBond donors 1
    HBond acceptors 9
    Atoms 57
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1619896.