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canSAR1968612
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NAMES
    SMILES
    CCCCNc1ccc2oc(-c3ccc(OC)cc3)c(-c3ccc(OC)c(F)c3)c2c1
    InChI
    InChI=1S/C26H26FNO3/c1-4-5-14-28-19-9-13-23-21(16-19)25(18-8-12-24(30-3)22(27)15-18)26(31-23)17-6-10-20(29-2)11-7-17/h6-13,15-16,28H,4-5,14H2,1-3H3
    MOLECULAR FORMULA
    C26H26FNO3
    CROSS REFERENCES
    1968612 logo

    canSAR1968612

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 419.19
    AlogP 7.14
    HBond donors 1
    HBond acceptors 4
    Atoms 57
    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 canSAR1968612.