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canSAR1116637
FEATURES
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NAMES
    SMILES
    O=c1c2ccccc2c2c(-c3ccccc3)c3c(=O)n(CCCCN4CCN(c5ccc(Cl)cc5)CC4)c(=O)c3c(-c3ccccc3)c12
    InChI
    InChI=1S/C41H34ClN3O3/c42-29-17-19-30(20-18-29)44-25-23-43(24-26-44)21-9-10-22-45-40(47)37-33(27-11-3-1-4-12-27)35-31-15-7-8-16-32(31)39(46)36(35)34(38(37)41(45)48)28-13-5-2-6-14-28/h1-8,11-20H,9-10,21-26H2
    MOLECULAR FORMULA
    C41H34ClN3O3
    CROSS REFERENCES
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    canSAR1116637

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 651.23
    AlogP 7.49
    HBond donors 0
    HBond acceptors 6
    Atoms 82
    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 canSAR1116637.