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canSAR1716325
FEATURES
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NAMES
    SMILES
    O=S(=O)(c1cccc(F)c1)N1CC[C@@H]2[C@@H](CO)Nc3ccc(-c4cccc(F)c4)cc3[C@@H]21
    InChI
    InChI=1S/C24H22F2N2O3S/c25-17-4-1-3-15(11-17)16-7-8-22-21(12-16)24-20(23(14-29)27-22)9-10-28(24)32(30,31)19-6-2-5-18(26)13-19/h1-8,11-13,20,23-24,27,29H,9-10,14H2/t20-,23-,24-/m1/s1
    MOLECULAR FORMULA
    C24H22F2N2O3S
    CROSS REFERENCES
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    canSAR1716325

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 456.13
    AlogP 4.17
    HBond donors 2
    HBond acceptors 5
    Atoms 54
    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 canSAR1716325.