1830312 logo
canSAR1830312
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c([N+](=O)[O-])c1)N1CCCC1
    InChI
    InChI=1S/C22H24N4O4/c27-21-5-3-4-18-17-10-15(13-25(18)21)12-24(14-17)19-7-6-16(11-20(19)26(29)30)22(28)23-8-1-2-9-23/h3-7,11,15,17H,1-2,8-10,12-14H2
    MOLECULAR FORMULA
    C22H24N4O4
    CROSS REFERENCES
    1830312 logo

    canSAR1830312

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 408.18
    AlogP 2.62
    HBond donors 0
    HBond acceptors 8
    Atoms 54
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1830312.