466178 logo
canSAR466178
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(O)/C=C/c1cc(-c2ccccn2)n(C2CCCCC2)n1
    InChI
    InChI=1S/C17H19N3O2/c21-17(22)10-9-13-12-16(15-8-4-5-11-18-15)20(19-13)14-6-2-1-3-7-14/h4-5,8-12,14H,1-3,6-7H2,(H,21,22)/b10-9+
    MOLECULAR FORMULA
    C17H19N3O2
    CROSS REFERENCES
    466178 logo

    canSAR466178

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 297.15
    AlogP 3.55
    HBond donors 1
    HBond acceptors 5
    Atoms 41
    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 canSAR466178.