canSAR2080045
FEATURES
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NAMES
    SMILES
    C#Cc1cc(Oc2cnc(NCCN3CCCCC3)nc2N)c(C(C)C)cc1OC
    InChI
    InChI=1S/C23H31N5O2/c1-5-17-13-20(18(16(2)3)14-19(17)29-4)30-21-15-26-23(27-22(21)24)25-9-12-28-10-7-6-8-11-28/h1,13-16H,6-12H2,2-4H3,(H3,24,25,26,27)
    MOLECULAR FORMULA
    C23H31N5O2
    CROSS REFERENCES
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    canSAR2080045
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight409.25
    AlogP3.86
    HBond donors3
    HBond acceptors7
    Atoms61
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080045.