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canSAR1152342
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NAMES
    SMILES
    CC[C@H](CCn1cncn1)c1ccccc1
    InChI
    InChI=1S/C13H17N3/c1-2-12(13-6-4-3-5-7-13)8-9-16-11-14-10-15-16/h3-7,10-12H,2,8-9H2,1H3/t12-/m1/s1
    MOLECULAR FORMULA
    C13H17N3
    CROSS REFERENCES
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    canSAR1152342

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 215.14
    AlogP 2.86
    HBond donors 0
    HBond acceptors 3
    Atoms 33
    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 canSAR1152342.