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canSAR114315
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NAMES
    SMILES
    N=C(N)NCCCN(Cc1ccc2ccccc2c1)C(=O)CCCc1c[nH]c2ccccc12
    InChI
    InChI=1S/C27H31N5O/c28-27(29)30-15-6-16-32(19-20-13-14-21-7-1-2-8-22(21)17-20)26(33)12-5-9-23-18-31-25-11-4-3-10-24(23)25/h1-4,7-8,10-11,13-14,17-18,31H,5-6,9,12,15-16,19H2,(H4,28,29,30)
    MOLECULAR FORMULA
    C27H31N5O
    CROSS REFERENCES
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    canSAR114315

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 441.25
    AlogP 4.55
    HBond donors 5
    HBond acceptors 6
    Atoms 64
    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 canSAR114315.