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canSAR1149856
FEATURES
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NAMES
    SMILES
    N#Cc1c(-c2ccc(OCC3CCOC3)c(OC(F)(F)F)c2)nc(N)[nH]c1=O
    InChI
    InChI=1S/C17H15F3N4O4/c18-17(19,20)28-13-5-10(14-11(6-21)15(25)24-16(22)23-14)1-2-12(13)27-8-9-3-4-26-7-9/h1-2,5,9H,3-4,7-8H2,(H3,22,23,24,25)
    MOLECULAR FORMULA
    C17H15F3N4O4
    CROSS REFERENCES
    1149856 logo

    canSAR1149856

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 396.10
    AlogP 2.20
    HBond donors 3
    HBond acceptors 8
    Atoms 43
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1149856.