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canSAR2019421
FEATURES
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NAMES
    SMILES
    COc1cc(C)c([S+](=O)([O-])Nc2c(C)nn(CCc3ccccc3)c2C)c(C)c1C
    InChI
    InChI=1S/C23H29N3O3S/c1-15-14-21(29-6)16(2)17(3)23(15)30(27,28)25-22-18(4)24-26(19(22)5)13-12-20-10-8-7-9-11-20/h7-11,14H,12-13H2,1-6H3,(H-,25,27,28)
    MOLECULAR FORMULA
    C23H29N3O3S
    CROSS REFERENCES
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    canSAR2019421

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.19
    AlogP 4.69
    HBond donors 1
    HBond acceptors 6
    Atoms 59
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2019421.