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canSAR781789
FEATURES
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NAMES
    SMILES
    COc1cc(COc2c(OC)ccc3c2C(=O)O[C@@H]3[C@H]2c3c(cc4c(c3OC)OCO4)CCN2C)cc(OC)c1OC
    InChI
    InChI=1S/C31H33NO10/c1-32-10-9-17-13-22-29(41-15-40-22)30(38-6)23(17)25(32)26-18-7-8-19(34-2)28(24(18)31(33)42-26)39-14-16-11-20(35-3)27(37-5)21(12-16)36-4/h7-8,11-13,25-26H,9-10,14-15H2,1-6H3/t25-,26+/m1/s1
    MOLECULAR FORMULA
    C31H33NO10
    CROSS REFERENCES
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    canSAR781789

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 579.21
    AlogP 4.48
    HBond donors 0
    HBond acceptors 11
    Atoms 75
    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 canSAR781789.