canSAR1000919
FEATURES
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NAMES
    SMILES
    Cc1nc(Nc2ccc3sc(C(=O)Nc4c(C)cccc4Cl)cc3c2)cc(N2CCC(C)CC2)n1
    InChI
    InChI=1S/C27H28ClN5OS/c1-16-9-11-33(12-10-16)25-15-24(29-18(3)30-25)31-20-7-8-22-19(13-20)14-23(35-22)27(34)32-26-17(2)5-4-6-21(26)28/h4-8,13-16H,9-12H2,1-3H3,(H,32,34)(H,29,30,31)
    MOLECULAR FORMULA
    C27H28ClN5OS
    CROSS REFERENCES
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    canSAR1000919
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight505.17
    AlogP7.19
    HBond donors2
    HBond acceptors6
    Atoms63
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1000919.