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canSAR35114
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NAMES
    SMILES
    CN(CCCC(=O)NCC1=CCc2ccccc2C(CC(=O)O)C1)c1ccccn1
    InChI
    InChI=1S/C24H29N3O3/c1-27(22-9-4-5-13-25-22)14-6-10-23(28)26-17-18-11-12-19-7-2-3-8-21(19)20(15-18)16-24(29)30/h2-5,7-9,11,13,20H,6,10,12,14-17H2,1H3,(H,26,28)(H,29,30)
    MOLECULAR FORMULA
    C24H29N3O3
    CROSS REFERENCES
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    canSAR35114

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 407.22
    AlogP 3.55
    HBond donors 2
    HBond acceptors 6
    Atoms 59
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR35114.