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canSAR1491966
FEATURES
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NAMES
    SMILES
    COc1c(O)ccc2c1-c1ccc3c(c1C(=Cc1sccc1C(=O)C1CCCCC1)O2)C(C)=CC(C)(C)N3
    InChI
    InChI=1S/C32H33NO4S/c1-18-17-32(2,3)33-22-11-10-21-28(27(18)22)25(37-24-13-12-23(34)31(36-4)29(21)24)16-26-20(14-15-38-26)30(35)19-8-6-5-7-9-19/h10-17,19,33-34H,5-9H2,1-4H3
    MOLECULAR FORMULA
    C32H33NO4S
    CROSS REFERENCES
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    canSAR1491966

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 527.21
    AlogP 8.39
    HBond donors 2
    HBond acceptors 5
    Atoms 71
    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 canSAR1491966.