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canSAR1971453
FEATURES
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NAMES
    SMILES
    O=C(C1CCCN(Cc2ccccc2F)C1)N1CCc2ccccc2C1.O=C(O)C(=O)O
    InChI
    InChI=1S/C22H25FN2O.C2H2O4/c23-21-10-4-3-8-19(21)14-24-12-5-9-20(15-24)22(26)25-13-11-17-6-1-2-7-18(17)16-25;3-1(4)2(5)6/h1-4,6-8,10,20H,5,9,11-16H2;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C24H27FN2O5
    CROSS REFERENCES
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    canSAR1971453

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.19
    AlogP 2.78
    HBond donors 2
    HBond acceptors 7
    Atoms 59
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1971453.