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canSAR545766
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NAMES
    SMILES
    Cc1cc(NC(=O)c2ccc3c(c2)CCNC3)nn1Cc1cc(Cl)ccc1OCC(C)C
    InChI
    InChI=1S/C25H29ClN4O2/c1-16(2)15-32-23-7-6-22(26)12-21(23)14-30-17(3)10-24(29-30)28-25(31)19-4-5-20-13-27-9-8-18(20)11-19/h4-7,10-12,16,27H,8-9,13-15H2,1-3H3,(H,28,29,31)
    MOLECULAR FORMULA
    C25H29ClN4O2
    CROSS REFERENCES
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    canSAR545766

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 452.20
    AlogP 4.83
    HBond donors 2
    HBond acceptors 6
    Atoms 61
    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 canSAR545766.