canSAR2192910
FEATURES
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NAMES
    SMILES
    N[C@]1(COP(=O)(O)O)CC[C@H](c2ccc3c(c2)CC[C@H](CSCCc2cnccn2)C3)C1
    InChI
    InChI=1S/C23H32N3O4PS/c24-23(16-30-31(27,28)29)7-5-21(13-23)20-4-3-18-11-17(1-2-19(18)12-20)15-32-10-6-22-14-25-8-9-26-22/h3-4,8-9,12,14,17,21H,1-2,5-7,10-11,13,15-16,24H2,(H2,27,28,29)/t17-,21-,23+/m0/s1
    MOLECULAR FORMULA
    C23H32N3O4PS
    CROSS REFERENCES
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    canSAR2192910
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight477.19
    AlogP3.63
    HBond donors4
    HBond acceptors7
    Atoms64
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2192910.