canSAR1846831
FEATURES
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NAMES
    SMILES
    O=C(N/N=C1/CCS(=O)(=O)c2ccc(F)cc21)c1ccccn1
    InChI
    InChI=1S/C15H12FN3O3S/c16-10-4-5-14-11(9-10)12(6-8-23(14,21)22)18-19-15(20)13-3-1-2-7-17-13/h1-5,7,9H,6,8H2,(H,19,20)/b18-12-
    MOLECULAR FORMULA
    C15H12FN3O3S
    CROSS REFERENCES
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    canSAR1846831
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight333.06
    AlogP1.53
    HBond donors1
    HBond acceptors6
    Atoms35
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846831.