1150157 logo
canSAR1150157
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC1CCc2c1nn(C)c2C(=O)NCc1ccc(Oc2ccc([N+](=O)[O-])cc2)cc1
    InChI
    InChI=1S/C22H22N4O4/c1-14-3-12-19-20(14)24-25(2)21(19)22(27)23-13-15-4-8-17(9-5-15)30-18-10-6-16(7-11-18)26(28)29/h4-11,14H,3,12-13H2,1-2H3,(H,23,27)
    MOLECULAR FORMULA
    C22H22N4O4
    CROSS REFERENCES
    1150157 logo

    canSAR1150157

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 406.16
    AlogP 4.10
    HBond donors 1
    HBond acceptors 8
    Atoms 52
    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 canSAR1150157.