755669 logo
canSAR755669
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cc(O)c(C(=O)/C=C/c2ccc(OCc3ccccc3)cc2)c(-c2ccc(Br)cc2)c1C(=O)/C=C/c1ccc(OCc2ccccc2)cc1
    InChI
    InChI=1S/C45H35BrO5/c1-31-28-42(49)45(41(48)27-17-33-14-24-39(25-15-33)51-30-35-10-6-3-7-11-35)44(36-18-20-37(46)21-19-36)43(31)40(47)26-16-32-12-22-38(23-13-32)50-29-34-8-4-2-5-9-34/h2-28,49H,29-30H2,1H3/b26-16+,27-17+
    MOLECULAR FORMULA
    C45H35BrO5
    CROSS REFERENCES
    755669 logo

    canSAR755669

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 734.17
    AlogP 11.08
    HBond donors 1
    HBond acceptors 5
    Atoms 86
    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 canSAR755669.