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canSAR1127182
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NAMES
    SMILES
    Cc1ccc2c(c1)C1(C(=O)N2)C2=C(CN1c1c(C)noc1/C=C/c1ccccc1)C(=O)c1ccccc1C2=O
    InChI
    InChI=1S/C32H23N3O4/c1-18-12-14-25-24(16-18)32(31(38)33-25)27-23(29(36)21-10-6-7-11-22(21)30(27)37)17-35(32)28-19(2)34-39-26(28)15-13-20-8-4-3-5-9-20/h3-16H,17H2,1-2H3,(H,33,38)/b15-13+
    MOLECULAR FORMULA
    C32H23N3O4
    CROSS REFERENCES
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    canSAR1127182

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 513.17
    AlogP 5.51
    HBond donors 1
    HBond acceptors 7
    Atoms 62
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1127182.