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canSAR1131420
FEATURES
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NAMES
    SMILES
    COc1ccc2nccc([C@@H](O)CC[C@@H]3CCN(C4CC(c5c(F)ccc(F)c5OC)C4)C[C@@H]3C(=O)O)c2c1
    InChI
    InChI=1S/C30H34F2N2O5/c1-38-20-4-7-26-22(15-20)21(9-11-33-26)27(35)8-3-17-10-12-34(16-23(17)30(36)37)19-13-18(14-19)28-24(31)5-6-25(32)29(28)39-2/h4-7,9,11,15,17-19,23,27,35H,3,8,10,12-14,16H2,1-2H3,(H,36,37)/t17-,18?,19?,23+,27+/m1/s1
    MOLECULAR FORMULA
    C30H34F2N2O5
    CROSS REFERENCES
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    canSAR1131420

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 540.24
    AlogP 5.31
    HBond donors 2
    HBond acceptors 7
    Atoms 73
    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 canSAR1131420.