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canSAR1142173
FEATURES
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NAMES
    SMILES
    CN1C/C(=C\c2ccccc2F)C(=O)[C@]2(C1)[C@@H](c1ccccc1F)[C@@H]1CSCN1[C@@]21C(=O)c2cccc3cccc1c23
    InChI
    InChI=1S/C35H28F2N2O2S/c1-38-17-23(16-22-8-2-4-14-27(22)36)32(40)34(19-38)31(24-11-3-5-15-28(24)37)29-18-42-20-39(29)35(34)26-13-7-10-21-9-6-12-25(30(21)26)33(35)41/h2-16,29,31H,17-20H2,1H3/b23-16+/t29-,31-,34-,35-/m0/s1
    MOLECULAR FORMULA
    C35H28F2N2O2S
    CROSS REFERENCES
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    canSAR1142173

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 578.18
    AlogP 6.27
    HBond donors 0
    HBond acceptors 4
    Atoms 70
    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 canSAR1142173.