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canSAR2089646
FEATURES
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NAMES
    SMILES
    Cc1ccc(N2C(=O)[C@H](CCCNS(=O)(=O)c3cccs3)[C@H]2c2ccc([N+](=O)[O-])cc2)cc1
    InChI
    InChI=1S/C23H23N3O5S2/c1-16-6-10-18(11-7-16)25-22(17-8-12-19(13-9-17)26(28)29)20(23(25)27)4-2-14-24-33(30,31)21-5-3-15-32-21/h3,5-13,15,20,22,24H,2,4,14H2,1H3/t20-,22-/m1/s1
    MOLECULAR FORMULA
    C23H23N3O5S2
    CROSS REFERENCES
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    canSAR2089646

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 485.11
    AlogP 4.43
    HBond donors 1
    HBond acceptors 8
    Atoms 56
    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 canSAR2089646.