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canSAR1120867
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NAMES
    SMILES
    Nc1ncnc2c1c(C(=O)c1cccc(NC(=O)Nc3ccc(Cl)cc3)c1)cn2C1CCCC1
    InChI
    InChI=1S/C25H23ClN6O2/c26-16-8-10-17(11-9-16)30-25(34)31-18-5-3-4-15(12-18)22(33)20-13-32(19-6-1-2-7-19)24-21(20)23(27)28-14-29-24/h3-5,8-14,19H,1-2,6-7H2,(H2,27,28,29)(H2,30,31,34)
    MOLECULAR FORMULA
    C25H23ClN6O2
    CROSS REFERENCES
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    canSAR1120867

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 474.16
    AlogP 5.66
    HBond donors 4
    HBond acceptors 8
    Atoms 57
    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 canSAR1120867.