canSAR2165093
FEATURES
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NAMES
    SMILES
    COc1ccc(NC(=S)N2CCCC(c3ccccc3-c3cnc(N(C)C)nc3)C2)cc1
    InChI
    InChI=1S/C25H29N5OS/c1-29(2)24-26-15-19(16-27-24)23-9-5-4-8-22(23)18-7-6-14-30(17-18)25(32)28-20-10-12-21(31-3)13-11-20/h4-5,8-13,15-16,18H,6-7,14,17H2,1-3H3,(H,28,32)
    MOLECULAR FORMULA
    C25H29N5OS
    CROSS REFERENCES
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    canSAR2165093
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight447.21
    AlogP4.79
    HBond donors1
    HBond acceptors6
    Atoms61
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2165093.