canSAR2100421
FEATURES
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NAMES
    SMILES
    CNC(C)C(=O)Nc1cc(-c2c(C)ccc3ncccc23)cc(NC(=O)c2cc3c(cn2)COC3)n1
    InChI
    InChI=1S/C27H26N6O3/c1-15-6-7-21-20(5-4-8-29-21)25(15)17-10-23(32-26(34)16(2)28-3)31-24(11-17)33-27(35)22-9-18-13-36-14-19(18)12-30-22/h4-12,16,28H,13-14H2,1-3H3,(H2,31,32,33,34,35)
    MOLECULAR FORMULA
    C27H26N6O3
    CROSS REFERENCES
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    canSAR2100421
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight482.21
    AlogP3.83
    HBond donors3
    HBond acceptors9
    Atoms62
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2100421.