canSAR2181307
FEATURES
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NAMES
    SMILES
    O=C(Nc1nc2ccc(F)cc2s1)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1O[C@@H]1C(=O)O
    InChI
    InChI=1S/C17H14FN5O5S/c18-7-1-2-9-11(3-7)29-17(22-9)23-14(24)10(4-8-5-19-6-20-8)21-15(25)12-13(28-12)16(26)27/h1-3,5-6,10,12-13H,4H2,(H,19,20)(H,21,25)(H,26,27)(H,22,23,24)/t10-,12+,13-/m0/s1
    MOLECULAR FORMULA
    C17H14FN5O5S
    CROSS REFERENCES
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    canSAR2181307
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight419.07
    AlogP0.68
    HBond donors4
    HBond acceptors10
    Atoms43
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2181307.