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canSAR197513
FEATURES
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NAMES
    SMILES
    CC(=O)NC[C@H]1CN(c2ccc(/C=C(\F)c3cnc(N)nc3)c(F)c2)C(=O)O1
    InChI
    InChI=1S/C18H17F2N5O3/c1-10(26)22-8-14-9-25(18(27)28-14)13-3-2-11(16(20)5-13)4-15(19)12-6-23-17(21)24-7-12/h2-7,14H,8-9H2,1H3,(H,22,26)(H2,21,23,24)/b15-4-/t14-/m0/s1
    MOLECULAR FORMULA
    C18H17F2N5O3
    CROSS REFERENCES
    197513 logo

    canSAR197513

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 389.13
    AlogP 2.13
    HBond donors 3
    HBond acceptors 8
    Atoms 45
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR197513.