canSAR1387616
FEATURES
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NAMES
    SMILES
    CCn1nnc2c1C(COCCN(C)C)CN(S(C)(=O)=O)C2.O=C(O)C(F)(F)F
    InChI
    InChI=1S/C13H25N5O3S.C2HF3O2/c1-5-18-13-11(10-21-7-6-16(2)3)8-17(22(4,19)20)9-12(13)14-15-18;3-2(4,5)1(6)7/h11H,5-10H2,1-4H3;(H,6,7)
    MOLECULAR FORMULA
    C15H26F3N5O5S
    CROSS REFERENCES
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    canSAR1387616
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight445.16
    AlogP0.37
    HBond donors1
    HBond acceptors10
    Atoms55
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1387616.