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canSAR2091025
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NAMES
    SMILES
    COc1ccc(-c2sc(C)nc2C(=O)N2CCC[C@H]2Cc2ccc(OC)c(OC)c2)cc1
    InChI
    InChI=1S/C25H28N2O4S/c1-16-26-23(24(32-16)18-8-10-20(29-2)11-9-18)25(28)27-13-5-6-19(27)14-17-7-12-21(30-3)22(15-17)31-4/h7-12,15,19H,5-6,13-14H2,1-4H3/t19-/m0/s1
    MOLECULAR FORMULA
    C25H28N2O4S
    CROSS REFERENCES
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    canSAR2091025

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 452.18
    AlogP 4.99
    HBond donors 0
    HBond acceptors 6
    Atoms 60
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2091025.