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canSAR1444810
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NAMES
    SMILES
    CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2cccc(OCc3ccccc3)c2)c1
    InChI
    InChI=1S/C30H30N4O3/c1-2-8-21-11-6-12-23(15-21)27-18-28(32-30(36)24-16-29(35)31-19-24)33-34(27)25-13-7-14-26(17-25)37-20-22-9-4-3-5-10-22/h3-7,9-15,17-18,24H,2,8,16,19-20H2,1H3,(H,31,35)(H,32,33,36)/t24-/m0/s1
    MOLECULAR FORMULA
    C30H30N4O3
    CROSS REFERENCES
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    canSAR1444810

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 494.23
    AlogP 5.15
    HBond donors 2
    HBond acceptors 7
    Atoms 67
    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 canSAR1444810.