canSAR1387794
FEATURES
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NAMES
    SMILES
    Cc1nnn2c1COC(CNCc1ccccn1)C2.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C13H17N5O.C2HF3O2/c1-10-13-9-19-12(8-18(13)17-16-10)7-14-6-11-4-2-3-5-15-11;3-2(4,5)1(6)7/h2-5,12,14H,6-9H2,1H3;(H,6,7)
    MOLECULAR FORMULA
    C15H18F3N5O3
    CROSS REFERENCES
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    canSAR1387794
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight373.14
    AlogP1.30
    HBond donors2
    HBond acceptors8
    Atoms44
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1387794.