552226 logo
canSAR552226
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CN(C)CCNC(=O)c1ccc(NCCN(C)C)c2cc3cc(N)ccc3nc12
    InChI
    InChI=1S/C22H30N6O/c1-27(2)11-9-24-20-8-6-17(22(29)25-10-12-28(3)4)21-18(20)14-15-13-16(23)5-7-19(15)26-21/h5-8,13-14,24H,9-12,23H2,1-4H3,(H,25,29)
    MOLECULAR FORMULA
    C22H30N6O
    CROSS REFERENCES
    552226 logo

    canSAR552226

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 394.25
    AlogP 2.24
    HBond donors 4
    HBond acceptors 7
    Atoms 59
    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 canSAR552226.