canSAR2064598
FEATURES
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NAMES
    SMILES
    CC1(C)OCc2c(Oc3n[nH]c4ccccc34)nc(-c3cn[nH]c3)nc21
    InChI
    InChI=1S/C18H16N6O2/c1-18(2)14-12(9-25-18)16(22-15(21-14)10-7-19-20-8-10)26-17-11-5-3-4-6-13(11)23-24-17/h3-8H,9H2,1-2H3,(H,19,20)(H,23,24)
    MOLECULAR FORMULA
    C18H16N6O2
    CROSS REFERENCES
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    canSAR2064598
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight348.13
    AlogP3.30
    HBond donors2
    HBond acceptors8
    Atoms42
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2064598.