canSAR82378
FEATURES
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NAMES
    SMILES
    Cn1c(CNc2ccc(C(=N)N)cc2)nc2cc(C(=O)N(CCCC(=O)O)c3ccccc3)ccc21
    InChI
    InChI=1S/C27H28N6O3/c1-32-23-14-11-19(27(36)33(15-5-8-25(34)35)21-6-3-2-4-7-21)16-22(23)31-24(32)17-30-20-12-9-18(10-13-20)26(28)29/h2-4,6-7,9-14,16,30H,5,8,15,17H2,1H3,(H3,28,29)(H,34,35)
    MOLECULAR FORMULA
    C27H28N6O3
    CROSS REFERENCES
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    canSAR82378
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight484.22
    AlogP3.98
    HBond donors5
    HBond acceptors9
    Atoms64
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR82378.