canSAR1651285
FEATURES
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NAMES
    SMILES
    O=c1cc(OCc2ccccc2)ccn1-c1ccc2c3c([nH]c2c1)CCN1CCCC31
    InChI
    InChI=1S/C26H25N3O2/c30-25-16-20(31-17-18-5-2-1-3-6-18)10-14-29(25)19-8-9-21-23(15-19)27-22-11-13-28-12-4-7-24(28)26(21)22/h1-3,5-6,8-10,14-16,24,27H,4,7,11-13,17H2
    MOLECULAR FORMULA
    C26H25N3O2
    CROSS REFERENCES
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    canSAR1651285
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight411.19
    AlogP4.59
    HBond donors1
    HBond acceptors5
    Atoms56
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1651285.