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canSAR2016154
FEATURES
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NAMES
    SMILES
    CCc1ncnc(-c2cc(F)c(C(=O)NCCN3CCNCC3)c(F)c2)c1C#Cc1ccc(N)nc1
    InChI
    InChI=1S/C26H27F2N7O/c1-2-22-19(5-3-17-4-6-23(29)32-15-17)25(34-16-33-22)18-13-20(27)24(21(28)14-18)26(36)31-9-12-35-10-7-30-8-11-35/h4,6,13-16,30H,2,7-12H2,1H3,(H2,29,32)(H,31,36)
    MOLECULAR FORMULA
    C26H27F2N7O
    CROSS REFERENCES
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    canSAR2016154

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 491.22
    AlogP 2.00
    HBond donors 4
    HBond acceptors 8
    Atoms 63
    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 canSAR2016154.