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canSAR1156994
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NAMES
    SMILES
    O=C(NNC1CCCCC1)c1ccncc1
    InChI
    InChI=1S/C12H17N3O/c16-12(10-6-8-13-9-7-10)15-14-11-4-2-1-3-5-11/h6-9,11,14H,1-5H2,(H,15,16)
    MOLECULAR FORMULA
    C12H17N3O
    CROSS REFERENCES
    1156994 logo

    canSAR1156994

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 219.14
    AlogP 1.65
    HBond donors 2
    HBond acceptors 4
    Atoms 33
    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 canSAR1156994.