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canSAR1119280
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NAMES
    SMILES
    CCCc1nc2c(C)cc(NC(=O)c3ccccc3)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1
    InChI
    InChI=1S/C32H29N3O3/c1-3-9-29-34-30-21(2)18-25(33-31(36)24-10-5-4-6-11-24)19-28(30)35(29)20-22-14-16-23(17-15-22)26-12-7-8-13-27(26)32(37)38/h4-8,10-19H,3,9,20H2,1-2H3,(H,33,36)(H,37,38)
    MOLECULAR FORMULA
    C32H29N3O3
    CROSS REFERENCES
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    canSAR1119280

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 503.22
    AlogP 6.96
    HBond donors 2
    HBond acceptors 6
    Atoms 67
    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 canSAR1119280.