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canSAR2000784
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NAMES
    SMILES
    O=C(N1C[C@@H]2C[C@H]1CN2c1cc(C(F)(F)F)ccn1)[C@@]12CCC[C@@H]1C[C@@H](N1CCC(c3ccccc3)CC1)C2
    InChI
    InChI=1S/C31H37F3N4O/c32-31(33,34)24-8-12-35-28(16-24)37-19-27-17-26(37)20-38(27)29(39)30-11-4-7-23(30)15-25(18-30)36-13-9-22(10-14-36)21-5-2-1-3-6-21/h1-3,5-6,8,12,16,22-23,25-27H,4,7,9-11,13-15,17-20H2/t23-,25-,26+,27+,30-/m1/s1
    MOLECULAR FORMULA
    C31H37F3N4O
    CROSS REFERENCES
    2000784 logo

    canSAR2000784

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 538.29
    AlogP 5.72
    HBond donors 0
    HBond acceptors 5
    Atoms 76
    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 canSAR2000784.