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canSAR1201603
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NAMES
    SMILES
    Nc1ccc(-c2ccccc2)cc1NC(=O)c1ccc(N2CCC3(CC2)CNC(=O)O3)nc1
    InChI
    InChI=1S/C25H25N5O3/c26-20-8-6-18(17-4-2-1-3-5-17)14-21(20)29-23(31)19-7-9-22(27-15-19)30-12-10-25(11-13-30)16-28-24(32)33-25/h1-9,14-15H,10-13,16,26H2,(H,28,32)(H,29,31)
    MOLECULAR FORMULA
    C25H25N5O3
    CROSS REFERENCES
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    canSAR1201603

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.20
    AlogP 3.66
    HBond donors 4
    HBond acceptors 8
    Atoms 58
    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 canSAR1201603.