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canSAR1724725
FEATURES
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NAMES
    SMILES
    CC[C@H](NC(=O)c1cc(F)ccc1[N-]S(=O)(=O)c1cccc2cccnc12)c1ccccc1.[Na+]
    InChI
    InChI=1S/C25H22FN3O3S.Na/c1-2-21(17-8-4-3-5-9-17)28-25(30)20-16-19(26)13-14-22(20)29-33(31,32)23-12-6-10-18-11-7-15-27-24(18)23;/h3-16,21H,2H2,1H3,(H2,28,29,30);/q;+1/p-1/t21-;/m0./s1
    MOLECULAR FORMULA
    C25H21FN3NaO3S
    CROSS REFERENCES
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    canSAR1724725

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 485.12
    AlogP 2.65
    HBond donors 1
    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 canSAR1724725.