499501 logo
canSAR499501
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Nc1ccc(-n2nc(-c3ccc(Oc4ccccc4)cc3)cc2N2CCOCC2)cc1
    InChI
    InChI=1S/C25H24N4O2/c26-20-8-10-21(11-9-20)29-25(28-14-16-30-17-15-28)18-24(27-29)19-6-12-23(13-7-19)31-22-4-2-1-3-5-22/h1-13,18H,14-17,26H2
    MOLECULAR FORMULA
    C25H24N4O2
    CROSS REFERENCES
    499501 logo

    canSAR499501

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.19
    AlogP 4.75
    HBond donors 2
    HBond acceptors 6
    Atoms 55
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR499501.