canSAR825449
FEATURES
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NAMES
    SMILES
    COc1ccc(C2N=C(SCc3cccc(Cl)c3)NC(C)=C2C(=O)Nc2ccc(F)cc2)cc1OC
    InChI
    InChI=1S/C27H25ClFN3O3S/c1-16-24(26(33)31-21-10-8-20(29)9-11-21)25(18-7-12-22(34-2)23(14-18)35-3)32-27(30-16)36-15-17-5-4-6-19(28)13-17/h4-14,25H,15H2,1-3H3,(H,30,32)(H,31,33)
    MOLECULAR FORMULA
    C27H25ClFN3O3S
    CROSS REFERENCES
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    canSAR825449
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight525.13
    AlogP6.34
    HBond donors2
    HBond acceptors6
    Atoms61
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR825449.