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canSAR1970110
FEATURES
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NAMES
    SMILES
    Cc1ccc(-c2cc(C(=O)Nc3ccc([S+](N)(=O)[O-])cc3)c3cccc(C)c3n2)cc1C
    InChI
    InChI=1S/C25H23N3O3S/c1-15-7-8-18(13-17(15)3)23-14-22(21-6-4-5-16(2)24(21)28-23)25(29)27-19-9-11-20(12-10-19)32(26,30)31/h4-14H,1-3H3,(H3-,26,27,29,30,31)
    MOLECULAR FORMULA
    C25H23N3O3S
    CROSS REFERENCES
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    canSAR1970110

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 445.15
    AlogP 4.94
    HBond donors 3
    HBond acceptors 6
    Atoms 55
    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 canSAR1970110.