canSAR389863
FEATURES
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NAMES
    SMILES
    C[C@@H](Oc1cc(-c2cnc3ccccn23)sc1C(N)=O)c1ccccc1CO
    InChI
    InChI=1S/C21H19N3O3S/c1-13(15-7-3-2-6-14(15)12-25)27-17-10-18(28-20(17)21(22)26)16-11-23-19-8-4-5-9-24(16)19/h2-11,13,25H,12H2,1H3,(H2,22,26)/t13-/m1/s1
    MOLECULAR FORMULA
    C21H19N3O3S
    CROSS REFERENCES
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    canSAR389863
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight393.11
    AlogP3.79
    HBond donors3
    HBond acceptors6
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR389863.