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canSAR346717
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NAMES
    SMILES
    N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)Nc1ccc2ccccc2c1
    InChI
    InChI=1S/C25H25N5O2/c26-22(12-17-6-2-1-3-7-17)24(31)30-23(14-21-15-27-16-28-21)25(32)29-20-11-10-18-8-4-5-9-19(18)13-20/h1-11,13,15-16,22-23H,12,14,26H2,(H,27,28)(H,29,32)(H,30,31)/t22-,23-/m0/s1
    MOLECULAR FORMULA
    C25H25N5O2
    CROSS REFERENCES
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    canSAR346717

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.20
    AlogP 2.80
    HBond donors 5
    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 canSAR346717.