canSAR613138
FEATURES
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NAMES
    SMILES
    CN(C)c1ccc(/C=C2\N=C(c3ccccc3)N(c3nc4ccc(Sc5ccccc5)cc4[nH]3)C2=O)cc1
    InChI
    InChI=1S/C31H25N5OS/c1-35(2)23-15-13-21(14-16-23)19-28-30(37)36(29(32-28)22-9-5-3-6-10-22)31-33-26-18-17-25(20-27(26)34-31)38-24-11-7-4-8-12-24/h3-20H,1-2H3,(H,33,34)/b28-19-
    MOLECULAR FORMULA
    C31H25N5OS
    CROSS REFERENCES
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    canSAR613138
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight515.18
    AlogP6.61
    HBond donors1
    HBond acceptors6
    Atoms63
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR613138.