canSAR1534261
FEATURES
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NAMES
    SMILES
    COc1ccccc1C1c2c(n[nH]c2C(C)C)C(=O)N1c1ccc(-c2ccsc2)c(N)c1
    InChI
    InChI=1S/C25H24N4O2S/c1-14(2)22-21-23(28-27-22)25(30)29(24(21)18-6-4-5-7-20(18)31-3)16-8-9-17(19(26)12-16)15-10-11-32-13-15/h4-14,24H,26H2,1-3H3,(H,27,28)
    MOLECULAR FORMULA
    C25H24N4O2S
    CROSS REFERENCES
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    canSAR1534261
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight444.16
    AlogP5.60
    HBond donors3
    HBond acceptors6
    Atoms56
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1534261.