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canSAR1127108
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NAMES
    SMILES
    COC(=O)NC1CCN(c2ncnc3c2nc(-c2ccccc2Cl)n3-c2ccc(Cl)cc2)CC1
    InChI
    InChI=1S/C24H22Cl2N6O2/c1-34-24(33)29-16-10-12-31(13-11-16)22-20-23(28-14-27-22)32(17-8-6-15(25)7-9-17)21(30-20)18-4-2-3-5-19(18)26/h2-9,14,16H,10-13H2,1H3,(H,29,33)
    MOLECULAR FORMULA
    C24H22Cl2N6O2
    CROSS REFERENCES
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    canSAR1127108

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 496.12
    AlogP 5.11
    HBond donors 1
    HBond acceptors 8
    Atoms 56
    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 canSAR1127108.