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canSAR1766367
FEATURES
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NAMES
    SMILES
    COc1cccc(S(=O)(=O)N(C)C[C@H]2Oc3cc(C4=CCCC4)ccc3S(=O)(=O)N([C@H](C)CO)C[C@@H]2C)c1
    InChI
    InChI=1S/C27H36N2O7S2/c1-19-16-29(20(2)18-30)38(33,34)27-13-12-22(21-8-5-6-9-21)14-25(27)36-26(19)17-28(3)37(31,32)24-11-7-10-23(15-24)35-4/h7-8,10-15,19-20,26,30H,5-6,9,16-18H2,1-4H3/t19-,20+,26+/m0/s1
    MOLECULAR FORMULA
    C27H36N2O7S2
    CROSS REFERENCES
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    canSAR1766367

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 564.20
    AlogP 3.35
    HBond donors 1
    HBond acceptors 9
    Atoms 74
    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 canSAR1766367.