724785 logo
canSAR724785
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCCc1nc2cccc(CCCl)c2n1Cc1ccc(-c2ccccc2C(=O)O)cc1
    InChI
    InChI=1S/C27H27ClN2O2/c1-2-3-11-25-29-24-10-6-7-21(16-17-28)26(24)30(25)18-19-12-14-20(15-13-19)22-8-4-5-9-23(22)27(31)32/h4-10,12-15H,2-3,11,16-18H2,1H3,(H,31,32)
    MOLECULAR FORMULA
    C27H27ClN2O2
    CROSS REFERENCES
    724785 logo

    canSAR724785

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.18
    AlogP 6.57
    HBond donors 1
    HBond acceptors 4
    Atoms 59
    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 canSAR724785.