canSAR1387049
FEATURES
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NAMES
    SMILES
    NCCCC(=O)N1CC2(C[C@H]1C(=O)NCCCCCC(=O)NO)SCCS2
    InChI
    InChI=1S/C17H30N4O4S2/c18-7-4-6-15(23)21-12-17(26-9-10-27-17)11-13(21)16(24)19-8-3-1-2-5-14(22)20-25/h13,25H,1-12,18H2,(H,19,24)(H,20,22)/t13-/m0/s1
    MOLECULAR FORMULA
    C17H30N4O4S2
    CROSS REFERENCES
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    canSAR1387049
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight418.17
    AlogP0.68
    HBond donors5
    HBond acceptors8
    Atoms57
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1387049.