canSAR1931885
FEATURES
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NAMES
    SMILES
    Cc1ccc(C(=O)n2nc(C(C)(C)C)cc2N)cc1Nc1ncnc2cnc(NC3CCOC3)nc12
    InChI
    InChI=1S/C25H29N9O2/c1-14-5-6-15(23(35)34-20(26)10-19(33-34)25(2,3)4)9-17(14)31-22-21-18(28-13-29-22)11-27-24(32-21)30-16-7-8-36-12-16/h5-6,9-11,13,16H,7-8,12,26H2,1-4H3,(H,27,30,32)(H,28,29,31)
    MOLECULAR FORMULA
    C25H29N9O2
    CROSS REFERENCES
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    canSAR1931885
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight487.24
    AlogP3.44
    HBond donors4
    HBond acceptors11
    Atoms65
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1931885.