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canSAR1591381
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NAMES
    SMILES
    C[C@H](CCCc1ccccc1)NC(=O)Nc1ccc2ncc(-c3ccc(CO)cc3)nc2n1
    InChI
    InChI=1S/C26H27N5O2/c1-18(6-5-9-19-7-3-2-4-8-19)28-26(33)31-24-15-14-22-25(30-24)29-23(16-27-22)21-12-10-20(17-32)11-13-21/h2-4,7-8,10-16,18,32H,5-6,9,17H2,1H3,(H2,28,29,30,31,33)/t18-/m1/s1
    MOLECULAR FORMULA
    C26H27N5O2
    CROSS REFERENCES
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    canSAR1591381

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 441.22
    AlogP 4.72
    HBond donors 3
    HBond acceptors 7
    Atoms 60
    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 canSAR1591381.