canSAR1388139
FEATURES
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NAMES
    SMILES
    CCCS(=O)(=O)N1CCOC2(CCCN(c3ccccn3)C2)C1.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C16H25N3O3S.C2HF3O2/c1-2-12-23(20,21)19-10-11-22-16(14-19)7-5-9-18(13-16)15-6-3-4-8-17-15;3-2(4,5)1(6)7/h3-4,6,8H,2,5,7,9-14H2,1H3;(H,6,7)
    MOLECULAR FORMULA
    C18H26F3N3O5S
    CROSS REFERENCES
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    canSAR1388139
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight453.15
    AlogP2.13
    HBond donors1
    HBond acceptors8
    Atoms56
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1388139.