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canSAR2205450
FEATURES
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NAMES
    SMILES
    CC(C)N(C(=O)Oc1ccc(F)cc1)[C@H]1CN(C(=O)C2CCN(c3ccc(C#N)cn3)CC2)C[C@@H]1c1ccc(Cl)cc1
    InChI
    InChI=1S/C32H33ClFN5O3/c1-21(2)39(32(41)42-27-10-8-26(34)9-11-27)29-20-38(19-28(29)23-4-6-25(33)7-5-23)31(40)24-13-15-37(16-14-24)30-12-3-22(17-35)18-36-30/h3-12,18,21,24,28-29H,13-16,19-20H2,1-2H3/t28-,29+/m1/s1
    MOLECULAR FORMULA
    C32H33ClFN5O3
    CROSS REFERENCES
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    canSAR2205450

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 589.23
    AlogP 5.87
    HBond donors 0
    HBond acceptors 8
    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 canSAR2205450.