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canSAR400308
FEATURES
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NAMES
    SMILES
    CC(=O)NC[C@H]1CN(c2ccc(N3CCCN(C)S3(=O)=O)c(F)c2)C(=O)O1
    InChI
    InChI=1S/C16H21FN4O5S/c1-11(22)18-9-13-10-20(16(23)26-13)12-4-5-15(14(17)8-12)21-7-3-6-19(2)27(21,24)25/h4-5,8,13H,3,6-7,9-10H2,1-2H3,(H,18,22)/t13-/m0/s1
    MOLECULAR FORMULA
    C16H21FN4O5S
    CROSS REFERENCES
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    canSAR400308

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.12
    AlogP 0.67
    HBond donors 1
    HBond acceptors 9
    Atoms 48
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR400308.