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canSAR834595
FEATURES
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NAMES
    SMILES
    CC1(Cc2ccccc2)CC(S(=O)(=O)c2ccc(/C(N)=N/O)cc2)=C(c2ccc(Nc3ccccc3/C(N)=N/O)cc2)O1
    InChI
    InChI=1S/C32H31N5O5S/c1-32(19-21-7-3-2-4-8-21)20-28(43(40,41)25-17-13-23(14-18-25)30(33)36-38)29(42-32)22-11-15-24(16-12-22)35-27-10-6-5-9-26(27)31(34)37-39/h2-18,35,38-39H,19-20H2,1H3,(H2,33,36)(H2,34,37)
    MOLECULAR FORMULA
    C32H31N5O5S
    CROSS REFERENCES
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    canSAR834595

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 597.20
    AlogP 5.18
    HBond donors 7
    HBond acceptors 10
    Atoms 74
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR834595.