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canSAR558790
FEATURES
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NAMES
    SMILES
    CC(C)[C@H](NC(=O)Oc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)C(F)(F)CNCc1ccccc1)C(C)C
    InChI
    InChI=1S/C31H40F2N4O5/c1-20(2)25(27(38)31(32,33)19-34-18-22-12-7-5-8-13-22)35-28(39)24-16-11-17-37(24)29(40)26(21(3)4)36-30(41)42-23-14-9-6-10-15-23/h5-10,12-15,20-21,24-26,34H,11,16-19H2,1-4H3,(H,35,39)(H,36,41)/t24-,25-,26-/m0/s1
    MOLECULAR FORMULA
    C31H40F2N4O5
    CROSS REFERENCES
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    canSAR558790

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 586.30
    AlogP 3.93
    HBond donors 3
    HBond acceptors 9
    Atoms 82
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR558790.