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canSAR110567
FEATURES
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NAMES
    SMILES
    CCCC(=O)Nc1cnc2c(nc(CCC)n2Cc2ccc(-c3ccccc3S(=O)(=O)NC(=O)c3ccccc3)cc2)c1C
    InChI
    InChI=1S/C34H35N5O4S/c1-4-11-30-37-32-23(3)28(36-31(40)12-5-2)21-35-33(32)39(30)22-24-17-19-25(20-18-24)27-15-9-10-16-29(27)44(42,43)38-34(41)26-13-7-6-8-14-26/h6-10,13-21H,4-5,11-12,22H2,1-3H3,(H,36,40)(H,38,41)
    MOLECULAR FORMULA
    C34H35N5O4S
    CROSS REFERENCES
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    canSAR110567

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 609.24
    AlogP 6.26
    HBond donors 2
    HBond acceptors 9
    Atoms 79
    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 canSAR110567.