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canSAR1617085
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NAMES
    SMILES
    Cc1ccc(-n2c(SCC(=O)NCc3ccco3)nc3nc4c(cc3c2=O)COC(C)(C)C4)cc1
    InChI
    InChI=1S/C26H26N4O4S/c1-16-6-8-18(9-7-16)30-24(32)20-11-17-14-34-26(2,3)12-21(17)28-23(20)29-25(30)35-15-22(31)27-13-19-5-4-10-33-19/h4-11H,12-15H2,1-3H3,(H,27,31)
    MOLECULAR FORMULA
    C26H26N4O4S
    CROSS REFERENCES
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    canSAR1617085

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 490.17
    AlogP 3.94
    HBond donors 1
    HBond acceptors 8
    Atoms 61
    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 canSAR1617085.