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canSAR502702
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NAMES
    SMILES
    CC(C)NCCNc1ccnc2cc(Cl)ccc12
    InChI
    InChI=1S/C14H18ClN3/c1-10(2)16-7-8-18-13-5-6-17-14-9-11(15)3-4-12(13)14/h3-6,9-10,16H,7-8H2,1-2H3,(H,17,18)
    MOLECULAR FORMULA
    C14H18ClN3
    CROSS REFERENCES
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    canSAR502702

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 263.12
    AlogP 3.30
    HBond donors 2
    HBond acceptors 3
    Atoms 36
    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 canSAR502702.