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canSAR1829492
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NAMES
    SMILES
    COc1ccc2cc(C(c3nnnn3Cc3ccccc3)N3CCCCCC3)c(O)nc2c1
    InChI
    InChI=1S/C25H28N6O2/c1-33-20-12-11-19-15-21(25(32)26-22(19)16-20)23(30-13-7-2-3-8-14-30)24-27-28-29-31(24)17-18-9-5-4-6-10-18/h4-6,9-12,15-16,23H,2-3,7-8,13-14,17H2,1H3,(H,26,32)
    MOLECULAR FORMULA
    C25H28N6O2
    CROSS REFERENCES
    1829492 logo

    canSAR1829492

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 444.23
    AlogP 3.95
    HBond donors 1
    HBond acceptors 8
    Atoms 61
    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 canSAR1829492.