6664 logo
canSAR6664
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCCC1=NC(CCCC)(CCCC)C(=O)N1Cc1ccc(-c2ccccc2C(=O)O)cc1
    InChI
    InChI=1S/C29H38N2O3/c1-4-7-14-26-30-29(19-8-5-2,20-9-6-3)28(34)31(26)21-22-15-17-23(18-16-22)24-12-10-11-13-25(24)27(32)33/h10-13,15-18H,4-9,14,19-21H2,1-3H3,(H,32,33)
    MOLECULAR FORMULA
    C29H38N2O3
    CROSS REFERENCES
    6664 logo

    canSAR6664

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.29
    AlogP 7.10
    HBond donors 1
    HBond acceptors 5
    Atoms 72
    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 canSAR6664.