canSAR163193
FEATURES
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NAMES
    SMILES
    CCOc1cccnc1COc1nn2c(-c3ccccc3)nnc2c2c1C1CCC2CC1
    InChI
    InChI=1S/C25H25N5O2/c1-2-31-20-9-6-14-26-19(20)15-32-25-22-17-12-10-16(11-13-17)21(22)24-28-27-23(30(24)29-25)18-7-4-3-5-8-18/h3-9,14,16-17H,2,10-13,15H2,1H3
    MOLECULAR FORMULA
    C25H25N5O2
    CROSS REFERENCES
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    canSAR163193
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight427.20
    AlogP4.92
    HBond donors0
    HBond acceptors7
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR163193.