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canSAR993957
FEATURES
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NAMES
    SMILES
    O=C1[C@H](NS(=O)(=O)c2ccc(N3CCN(c4ccccc4)CC3)cc2)CC=CCN1O
    InChI
    InChI=1S/C22H26N4O4S/c27-22-21(8-4-5-13-26(22)28)23-31(29,30)20-11-9-19(10-12-20)25-16-14-24(15-17-25)18-6-2-1-3-7-18/h1-7,9-12,21,23,28H,8,13-17H2/t21-/m1/s1
    MOLECULAR FORMULA
    C22H26N4O4S
    CROSS REFERENCES
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    canSAR993957

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.17
    AlogP 1.84
    HBond donors 2
    HBond acceptors 8
    Atoms 57
    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 canSAR993957.