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canSAR1208374
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NAMES
    SMILES
    COC1CCC2(CC1)Cc1ccc(-c3cccc(C#N)c3)cc1C21N=C(N)N(C)C1=O
    InChI
    InChI=1S/C25H26N4O2/c1-29-22(30)25(28-23(29)27)21-13-18(17-5-3-4-16(12-17)15-26)6-7-19(21)14-24(25)10-8-20(31-2)9-11-24/h3-7,12-13,20H,8-11,14H2,1-2H3,(H2,27,28)
    MOLECULAR FORMULA
    C25H26N4O2
    CROSS REFERENCES
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    canSAR1208374

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 414.21
    AlogP 3.34
    HBond donors 2
    HBond acceptors 6
    Atoms 57
    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 canSAR1208374.