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canSAR1014735
FEATURES
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NAMES
    SMILES
    COc1ccc2cc(CCC(=O)CC(Nc3ccc(S(N)(=O)=O)cc3)c3ccc(Cl)cc3)ccc2c1
    InChI
    InChI=1S/C28H27ClN2O4S/c1-35-26-13-7-21-16-19(2-4-22(21)17-26)3-12-25(32)18-28(20-5-8-23(29)9-6-20)31-24-10-14-27(15-11-24)36(30,33)34/h2,4-11,13-17,28,31H,3,12,18H2,1H3,(H2,30,33,34)
    MOLECULAR FORMULA
    C28H27ClN2O4S
    CROSS REFERENCES
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    canSAR1014735

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 522.14
    AlogP 5.89
    HBond donors 3
    HBond acceptors 6
    Atoms 63
    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 canSAR1014735.