784984 logo
canSAR784984
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC1CC2(C)CC(=O)C1C1C(=O)N(CCCN3CCN(c4ccccc4)CC3)C(=O)C12
    InChI
    InChI=1S/C25H33N3O3/c1-17-15-25(2)16-19(29)20(17)21-22(25)24(31)28(23(21)30)10-6-9-26-11-13-27(14-12-26)18-7-4-3-5-8-18/h3-5,7-8,17,20-22H,6,9-16H2,1-2H3
    MOLECULAR FORMULA
    C25H33N3O3
    CROSS REFERENCES
    784984 logo

    canSAR784984

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.25
    AlogP 2.44
    HBond donors 0
    HBond acceptors 6
    Atoms 64
    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 canSAR784984.