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canSAR673103
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NAMES
    SMILES
    CNC1CCN(c2ncnc3c2oc2ccc(Cl)cc23)CC1
    InChI
    InChI=1S/C16H17ClN4O/c1-18-11-4-6-21(7-5-11)16-15-14(19-9-20-16)12-8-10(17)2-3-13(12)22-15/h2-3,8-9,11,18H,4-7H2,1H3
    MOLECULAR FORMULA
    C16H17ClN4O
    CROSS REFERENCES
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    canSAR673103

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 316.11
    AlogP 3.22
    HBond donors 1
    HBond acceptors 5
    Atoms 39
    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 canSAR673103.