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canSAR1212290
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NAMES
    SMILES
    O=c1nc2n(CCN(CCO)CCO)c3cc(Cl)c(Cl)cc3nc-2c(=O)[nH]1
    InChI
    InChI=1S/C16H17Cl2N5O4/c17-9-7-11-12(8-10(9)18)23(2-1-22(3-5-24)4-6-25)14-13(19-11)15(26)21-16(27)20-14/h7-8,24-25H,1-6H2,(H,21,26,27)
    MOLECULAR FORMULA
    C16H17Cl2N5O4
    CROSS REFERENCES
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    canSAR1212290

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.07
    AlogP 0.18
    HBond donors 3
    HBond acceptors 9
    Atoms 44
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1212290.