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canSAR1985745
FEATURES
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NAMES
    SMILES
    CC[C@H](C)CNC(=O)c1ccnc(-c2ccc(CNC3Cc4ccccc4C3)cc2)c1
    InChI
    InChI=1S/C27H31N3O/c1-3-19(2)17-30-27(31)24-12-13-28-26(16-24)21-10-8-20(9-11-21)18-29-25-14-22-6-4-5-7-23(22)15-25/h4-13,16,19,25,29H,3,14-15,17-18H2,1-2H3,(H,30,31)/t19-/m0/s1
    MOLECULAR FORMULA
    C27H31N3O
    CROSS REFERENCES
    1985745 logo

    canSAR1985745

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.25
    AlogP 4.78
    HBond donors 2
    HBond acceptors 4
    Atoms 62
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1985745.