1089062 logo
canSAR1089062
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC#CCn1c(N2CCC[C@@H](N)C2)nc2ccn(C)c2c1=O
    InChI
    InChI=1S/C16H21N5O/c1-3-4-9-21-15(22)14-13(7-10-19(14)2)18-16(21)20-8-5-6-12(17)11-20/h7,10,12H,5-6,8-9,11,17H2,1-2H3/t12-/m1/s1
    MOLECULAR FORMULA
    C16H21N5O
    CROSS REFERENCES
    1089062 logo

    canSAR1089062

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 299.17
    AlogP 0.69
    HBond donors 2
    HBond acceptors 6
    Atoms 43
    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 canSAR1089062.