canSAR2152680
FEATURES
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NAMES
    SMILES
    COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(OC)(C(F)(F)F)C(F)(F)F)cc2)nc(-c2ncccn2)nc1OCCO
    InChI
    InChI=1S/C27H23F6N5O7S/c1-42-18-6-3-4-7-19(18)45-20-21(36-23(22-34-12-5-13-35-22)37-24(20)44-15-14-39)38-46(40,41)17-10-8-16(9-11-17)25(43-2,26(28,29)30)27(31,32)33/h3-13,39H,14-15H2,1-2H3,(H,36,37,38)
    MOLECULAR FORMULA
    C27H23F6N5O7S
    CROSS REFERENCES
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    canSAR2152680
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight675.12
    AlogP4.87
    HBond donors2
    HBond acceptors12
    Atoms69
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2152680.