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canSAR1023280
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NAMES
    SMILES
    O=C(Cc1cnc[nH]1)N[C@@H](COCc1ccccc1)C(=O)Nc1ccc(-c2ccccc2)cc1
    InChI
    InChI=1S/C27H26N4O3/c32-26(15-24-16-28-19-29-24)31-25(18-34-17-20-7-3-1-4-8-20)27(33)30-23-13-11-22(12-14-23)21-9-5-2-6-10-21/h1-14,16,19,25H,15,17-18H2,(H,28,29)(H,30,33)(H,31,32)/t25-/m0/s1
    MOLECULAR FORMULA
    C27H26N4O3
    CROSS REFERENCES
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    canSAR1023280

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 454.20
    AlogP 3.96
    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 canSAR1023280.