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canSAR745499
FEATURES
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NAMES
    SMILES
    CC/N=c1/cc2oc3cc(NCCCCl)c4ccccc4c3nc-2cc1C
    InChI
    InChI=1S/C22H22ClN3O/c1-3-24-17-12-20-19(11-14(17)2)26-22-16-8-5-4-7-15(16)18(13-21(22)27-20)25-10-6-9-23/h4-5,7-8,11-13,25H,3,6,9-10H2,1-2H3/b24-17-
    MOLECULAR FORMULA
    C22H22ClN3O
    CROSS REFERENCES
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    canSAR745499

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 379.15
    AlogP 5.36
    HBond donors 1
    HBond acceptors 4
    Atoms 49
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR745499.