1990059 logo
canSAR1990059
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCC(C)N1C(=O)C2(N=C1N)c1cc(C#N)ccc1C[C@]21CC[C@@H](OC)CC1
    InChI
    InChI=1S/C22H28N4O2/c1-4-14(2)26-19(27)22(25-20(26)24)18-11-15(13-23)5-6-16(18)12-21(22)9-7-17(28-3)8-10-21/h5-6,11,14,17H,4,7-10,12H2,1-3H3,(H2,24,25)/t14?,17-,21-,22?
    MOLECULAR FORMULA
    C22H28N4O2
    CROSS REFERENCES
    1990059 logo

    canSAR1990059

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 380.22
    AlogP 2.84
    HBond donors 2
    HBond acceptors 6
    Atoms 56
    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 canSAR1990059.