canSAR2193975
FEATURES
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NAMES
    SMILES
    CNC(=O)c1cnc(Nc2ccc3ncsc3c2)cc1NC1C2CC3CC1CC(O)(C3)C2
    InChI
    InChI=1S/C24H27N5O2S/c1-25-23(30)17-11-26-21(28-16-2-3-18-20(6-16)32-12-27-18)7-19(17)29-22-14-4-13-5-15(22)10-24(31,8-13)9-14/h2-3,6-7,11-15,22,31H,4-5,8-10H2,1H3,(H,25,30)(H2,26,28,29)
    MOLECULAR FORMULA
    C24H27N5O2S
    CROSS REFERENCES
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    canSAR2193975
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight449.19
    AlogP4.15
    HBond donors4
    HBond acceptors7
    Atoms59
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2193975.