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canSAR2052154
FEATURES
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NAMES
    SMILES
    CN(C[C@H]1[C@H](C(=O)Nc2ccc(Br)cc2)[C@@H]2C=C[C@H]1C21CC1)C(=O)Cc1ccccc1Cl
    InChI
    InChI=1S/C26H26BrClN2O2/c1-30(23(31)14-16-4-2-3-5-22(16)28)15-19-20-10-11-21(26(20)12-13-26)24(19)25(32)29-18-8-6-17(27)7-9-18/h2-11,19-21,24H,12-15H2,1H3,(H,29,32)/t19-,20-,21+,24+/m1/s1
    MOLECULAR FORMULA
    C26H26BrClN2O2
    CROSS REFERENCES
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    canSAR2052154

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 512.09
    AlogP 5.57
    HBond donors 1
    HBond acceptors 4
    Atoms 58
    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 canSAR2052154.