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canSAR1522520
FEATURES
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NAMES
    SMILES
    COc1cccc(CN(C(=O)Cc2c[nH]c3ccccc23)C(C(=O)NC2CCCCC2)c2cccs2)c1
    InChI
    InChI=1S/C30H33N3O3S/c1-36-24-12-7-9-21(17-24)20-33(28(34)18-22-19-31-26-14-6-5-13-25(22)26)29(27-15-8-16-37-27)30(35)32-23-10-3-2-4-11-23/h5-9,12-17,19,23,29,31H,2-4,10-11,18,20H2,1H3,(H,32,35)
    MOLECULAR FORMULA
    C30H33N3O3S
    CROSS REFERENCES
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    canSAR1522520

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 515.22
    AlogP 6.00
    HBond donors 2
    HBond acceptors 6
    Atoms 70
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1522520.