canSAR2095822
FEATURES
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NAMES
    SMILES
    C(=C/n1ncc2c(NC3CCCCC3)ncnc21)\c1ccccc1
    InChI
    InChI=1S/C19H21N5/c1-3-7-15(8-4-1)11-12-24-19-17(13-22-24)18(20-14-21-19)23-16-9-5-2-6-10-16/h1,3-4,7-8,11-14,16H,2,5-6,9-10H2,(H,20,21,23)/b12-11+
    MOLECULAR FORMULA
    C19H21N5
    CROSS REFERENCES
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    canSAR2095822
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight319.18
    AlogP4.20
    HBond donors1
    HBond acceptors5
    Atoms45
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095822.