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canSAR1089873
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NAMES
    SMILES
    COc1ccc(/C=C/c2cc(OC)cc(OC)c2/C=C/C(=O)NCCCl)cc1
    InChI
    InChI=1S/C22H24ClNO4/c1-26-18-8-5-16(6-9-18)4-7-17-14-19(27-2)15-21(28-3)20(17)10-11-22(25)24-13-12-23/h4-11,14-15H,12-13H2,1-3H3,(H,24,25)/b7-4+,11-10+
    MOLECULAR FORMULA
    C22H24ClNO4
    CROSS REFERENCES
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    canSAR1089873

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 401.14
    AlogP 4.25
    HBond donors 1
    HBond acceptors 5
    Atoms 52
    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 canSAR1089873.