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canSAR1150953
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NAMES
    SMILES
    CCN(Cc1ccc(Cl)nc1)C1=C([N+](=O)[O-])CN(C(C(=O)OCCO)c2ccc(Cl)cc2)CN1C
    InChI
    InChI=1S/C23H27Cl2N5O5/c1-3-28(13-16-4-9-20(25)26-12-16)22-19(30(33)34)14-29(15-27(22)2)21(23(32)35-11-10-31)17-5-7-18(24)8-6-17/h4-9,12,21,31H,3,10-11,13-15H2,1-2H3
    MOLECULAR FORMULA
    C23H27Cl2N5O5
    CROSS REFERENCES
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    canSAR1150953

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 523.14
    AlogP 3.14
    HBond donors 1
    HBond acceptors 10
    Atoms 62
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1150953.