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canSAR1016338
FEATURES
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NAMES
    SMILES
    COc1cc(/C=C2\CCCN3C2=NOC3(CO)c2ccc(C#N)cc2)ccc1-n1cnc(C)c1
    InChI
    InChI=1S/C26H25N5O3/c1-18-15-30(17-28-18)23-10-7-20(13-24(23)33-2)12-21-4-3-11-31-25(21)29-34-26(31,16-32)22-8-5-19(14-27)6-9-22/h5-10,12-13,15,17,32H,3-4,11,16H2,1-2H3/b21-12+
    MOLECULAR FORMULA
    C26H25N5O3
    CROSS REFERENCES
    1016338 logo

    canSAR1016338

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 455.20
    AlogP 3.73
    HBond donors 1
    HBond acceptors 8
    Atoms 59
    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 canSAR1016338.