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canSAR1445612
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NAMES
    SMILES
    COc1ccc(Oc2c(-c3ccc(OC)cc3)[s+]([O-])c3cc(OC)ccc23)cc1
    InChI
    InChI=1S/C23H20O5S/c1-25-16-6-4-15(5-7-16)23-22(28-18-10-8-17(26-2)9-11-18)20-13-12-19(27-3)14-21(20)29(23)24/h4-14H,1-3H3
    MOLECULAR FORMULA
    C23H20O5S
    CROSS REFERENCES
    1445612 logo

    canSAR1445612

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 408.10
    AlogP 6.05
    HBond donors 0
    HBond acceptors 5
    Atoms 49
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1445612.