canSAR1846941
FEATURES
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NAMES
    SMILES
    C/C(Cl)=C\Cn1c(NCCCn2ccnc2)nc2c1c(=O)n(C)c(=O)n2C
    InChI
    InChI=1S/C17H22ClN7O2/c1-12(18)5-9-25-13-14(22(2)17(27)23(3)15(13)26)21-16(25)20-6-4-8-24-10-7-19-11-24/h5,7,10-11H,4,6,8-9H2,1-3H3,(H,20,21)/b12-5+
    MOLECULAR FORMULA
    C17H22ClN7O2
    CROSS REFERENCES
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    canSAR1846941
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight391.15
    AlogP1.27
    HBond donors1
    HBond acceptors9
    Atoms49
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846941.