1998169 logo
canSAR1998169
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCOc1ccc(CN2CCN(C(=O)c3cccc4ccccc34)CC2)cc1.O=C(O)C(=O)O
    InChI
    InChI=1S/C24H26N2O2.C2H2O4/c1-2-28-21-12-10-19(11-13-21)18-25-14-16-26(17-15-25)24(27)23-9-5-7-20-6-3-4-8-22(20)23;3-1(4)2(5)6/h3-13H,2,14-18H2,1H3;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C26H28N2O6
    CROSS REFERENCES
    1998169 logo

    canSAR1998169

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 464.19
    AlogP 3.35
    HBond donors 2
    HBond acceptors 8
    Atoms 62
    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 canSAR1998169.