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canSAR1719800
FEATURES
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NAMES
    SMILES
    N#C[C@H]1[C@@H](c2ccc(C#Cc3ccccc3F)cc2)[C@@H](CO)N1C(=O)C1CCCC1
    InChI
    InChI=1S/C25H23FN2O2/c26-21-8-4-3-5-18(21)12-9-17-10-13-19(14-11-17)24-22(15-27)28(23(24)16-29)25(30)20-6-1-2-7-20/h3-5,8,10-11,13-14,20,22-24,29H,1-2,6-7,16H2/t22-,23+,24+/m0/s1
    MOLECULAR FORMULA
    C25H23FN2O2
    CROSS REFERENCES
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    canSAR1719800

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.17
    AlogP 3.59
    HBond donors 1
    HBond acceptors 4
    Atoms 53
    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 canSAR1719800.