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canSAR1829194
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NAMES
    SMILES
    O=C(NCc1cn(-c2ccccc2)c2cc(Cl)ccc2c1=O)c1ccc(N2CC[C@H](O)C2)nc1
    InChI
    InChI=1S/C26H23ClN4O3/c27-19-7-8-22-23(12-19)31(20-4-2-1-3-5-20)15-18(25(22)33)14-29-26(34)17-6-9-24(28-13-17)30-11-10-21(32)16-30/h1-9,12-13,15,21,32H,10-11,14,16H2,(H,29,34)/t21-/m0/s1
    MOLECULAR FORMULA
    C26H23ClN4O3
    CROSS REFERENCES
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    canSAR1829194

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 474.15
    AlogP 3.54
    HBond donors 2
    HBond acceptors 7
    Atoms 57
    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 canSAR1829194.