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canSAR1635874
FEATURES
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NAMES
    SMILES
    COc1ccccc1C(=O)Nc1cccc(N2CCC(NCc3cnn(-c4ccccc4)n3)CC2)c1
    InChI
    InChI=1S/C28H30N6O2/c1-36-27-13-6-5-12-26(27)28(35)31-22-8-7-11-25(18-22)33-16-14-21(15-17-33)29-19-23-20-30-34(32-23)24-9-3-2-4-10-24/h2-13,18,20-21,29H,14-17,19H2,1H3,(H,31,35)
    MOLECULAR FORMULA
    C28H30N6O2
    CROSS REFERENCES
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    canSAR1635874

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 482.24
    AlogP 4.29
    HBond donors 2
    HBond acceptors 8
    Atoms 66
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1635874.