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canSAR2096515
FEATURES
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NAMES
    SMILES
    COc1ccc([C@@H]2[C@H](Oc3ccccc3)C(=O)N2c2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-]
    InChI
    InChI=1S/C25H24N2O8/c1-31-19-11-10-15(12-18(19)27(29)30)22-24(35-17-8-6-5-7-9-17)25(28)26(22)16-13-20(32-2)23(34-4)21(14-16)33-3/h5-14,22,24H,1-4H3/t22-,24+/m1/s1
    MOLECULAR FORMULA
    C25H24N2O8
    CROSS REFERENCES
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    canSAR2096515

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.15
    AlogP 4.16
    HBond donors 0
    HBond acceptors 10
    Atoms 59
    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 canSAR2096515.