canSAR1386954
FEATURES
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NAMES
    SMILES
    Cc1nc(CO[C@H]2CN(C(=O)c3ccc[nH]3)[C@@H]3COC[C@H]32)cs1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C16H19N3O3S.C2HF3O2/c1-10-18-11(9-23-10)6-22-15-5-19(14-8-21-7-12(14)15)16(20)13-3-2-4-17-13;3-2(4,5)1(6)7/h2-4,9,12,14-15,17H,5-8H2,1H3;(H,6,7)
    MOLECULAR FORMULA
    C18H20F3N3O5S
    CROSS REFERENCES
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    canSAR1386954
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight447.11
    AlogP2.47
    HBond donors2
    HBond acceptors8
    Atoms50
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1386954.