canSAR742519
FEATURES
Loading...
NAMES
    SMILES
    O=C(O)CN(CC(=O)O)c1cc2oc(-c3ncc(C(=O)O)o3)cc2cc1OCCOc1c(F)cccc1N(CC(=O)O)CC(=O)O
    InChI
    InChI=1S/C28H24FN3O14/c29-15-2-1-3-16(31(10-22(33)34)11-23(35)36)26(15)44-5-4-43-19-6-14-7-20(27-30-9-21(46-27)28(41)42)45-18(14)8-17(19)32(12-24(37)38)13-25(39)40/h1-3,6-9H,4-5,10-13H2,(H,33,34)(H,35,36)(H,37,38)(H,39,40)(H,41,42)
    MOLECULAR FORMULA
    C28H24FN3O14
    CROSS REFERENCES
    Loading...
    canSAR742519
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight645.12
    AlogP2.33
    HBond donors5
    HBond acceptors17
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR742519.