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canSAR1405301
FEATURES
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NAMES
    SMILES
    COc1ccc(F)c(F)c1C(=O)c1cnc(NC2CCN([S+](C)(=O)[O-])CC2)nc1N
    InChI
    InChI=1S/C18H21F2N5O4S/c1-29-13-4-3-12(19)15(20)14(13)16(26)11-9-22-18(24-17(11)21)23-10-5-7-25(8-6-10)30(2,27)28/h3-4,9-10H,5-8H2,1-2H3,(H3-,21,22,23,24,26,27,28)
    MOLECULAR FORMULA
    C18H21F2N5O4S
    CROSS REFERENCES
    1405301 logo

    canSAR1405301

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 441.13
    AlogP 1.63
    HBond donors 3
    HBond acceptors 9
    Atoms 51
    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 canSAR1405301.