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canSAR2052631
FEATURES
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NAMES
    SMILES
    Cc1cc(N2CCOCC2)nc(NCCNc2ccnc3cc(Cl)ccc23)n1
    InChI
    InChI=1S/C20H23ClN6O/c1-14-12-19(27-8-10-28-11-9-27)26-20(25-14)24-7-6-23-17-4-5-22-18-13-15(21)2-3-16(17)18/h2-5,12-13H,6-11H2,1H3,(H,22,23)(H,24,25,26)
    MOLECULAR FORMULA
    C20H23ClN6O
    CROSS REFERENCES
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    canSAR2052631

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.16
    AlogP 3.35
    HBond donors 2
    HBond acceptors 7
    Atoms 51
    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 canSAR2052631.