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canSAR1651753
FEATURES
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NAMES
    SMILES
    CC1(C)CC(=O)C=C(NCCN2CCN(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C1
    InChI
    InChI=1S/C21H28Cl2N4O2/c1-21(2)13-16(11-17(28)14-21)24-5-6-26-7-9-27(10-8-26)20(29)25-15-3-4-18(22)19(23)12-15/h3-4,11-12,24H,5-10,13-14H2,1-2H3,(H,25,29)
    MOLECULAR FORMULA
    C21H28Cl2N4O2
    CROSS REFERENCES
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    canSAR1651753

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.16
    AlogP 4.01
    HBond donors 2
    HBond acceptors 6
    Atoms 57
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1651753.