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canSAR1268531
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NAMES
    SMILES
    O=C(/C=C/c1cc2c(c(C(F)(F)F)c1)OCO2)N1CCNCC1
    InChI
    InChI=1S/C15H15F3N2O3/c16-15(17,18)11-7-10(8-12-14(11)23-9-22-12)1-2-13(21)20-5-3-19-4-6-20/h1-2,7-8,19H,3-6,9H2/b2-1+
    MOLECULAR FORMULA
    C15H15F3N2O3
    CROSS REFERENCES
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    canSAR1268531

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 328.10
    AlogP 1.88
    HBond donors 1
    HBond acceptors 5
    Atoms 38
    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 canSAR1268531.