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canSAR112690
FEATURES
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NAMES
    SMILES
    COc1ccc(CNC2CCN(S(=O)(=O)CCC3CCc4ccccc4N3S(=O)(=O)c3ccc(OC)cc3OC)CC2)cc1
    InChI
    InChI=1S/C32H41N3O7S2/c1-40-28-12-8-24(9-13-28)23-33-26-16-19-34(20-17-26)43(36,37)21-18-27-11-10-25-6-4-5-7-30(25)35(27)44(38,39)32-15-14-29(41-2)22-31(32)42-3/h4-9,12-15,22,26-27,33H,10-11,16-21,23H2,1-3H3
    MOLECULAR FORMULA
    C32H41N3O7S2
    CROSS REFERENCES
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    canSAR112690

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 643.24
    AlogP 4.20
    HBond donors 1
    HBond acceptors 10
    Atoms 85
    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 canSAR112690.