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canSAR1205294
FEATURES
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NAMES
    SMILES
    O=C(NC(CS)C(=O)N(C(=O)NC1CCCCC1)C1CCCCC1)/C(=C\c1ccc(F)cc1)NC(=O)c1ccccc1
    InChI
    InChI=1S/C32H39FN4O4S/c33-24-18-16-22(17-19-24)20-27(35-29(38)23-10-4-1-5-11-23)30(39)36-28(21-42)31(40)37(26-14-8-3-9-15-26)32(41)34-25-12-6-2-7-13-25/h1,4-5,10-11,16-20,25-26,28,42H,2-3,6-9,12-15,21H2,(H,34,41)(H,35,38)(H,36,39)/b27-20+
    MOLECULAR FORMULA
    C32H39FN4O4S
    CROSS REFERENCES
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    canSAR1205294

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 594.27
    AlogP 5.21
    HBond donors 3
    HBond acceptors 8
    Atoms 81
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1205294.