canSAR2094019
FEATURES
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NAMES
    SMILES
    COc1ccc([C@@H]2[C@H](Oc3ccccc3)C(=S)N2c2cc(OC)c(OC)c(OC)c2)cc1O
    InChI
    InChI=1S/C25H25NO6S/c1-28-19-11-10-15(12-18(19)27)22-24(32-17-8-6-5-7-9-17)25(33)26(22)16-13-20(29-2)23(31-4)21(14-16)30-3/h5-14,22,24,27H,1-4H3/t22-,24+/m1/s1
    MOLECULAR FORMULA
    C25H25NO6S
    CROSS REFERENCES
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    canSAR2094019
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight467.14
    AlogP4.76
    HBond donors1
    HBond acceptors7
    Atoms58
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2094019.