1716658 logo
canSAR1716658
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCOC(=O)C1C(=O)C2=C(CC1c1ccco1)N=C(C)C(=C(O)OCC)C2c1ccccn1
    InChI
    InChI=1S/C25H26N2O6/c1-4-31-24(29)19-14(3)27-17-13-15(18-10-8-12-33-18)20(25(30)32-5-2)23(28)22(17)21(19)16-9-6-7-11-26-16/h6-12,15,20-21,29H,4-5,13H2,1-3H3
    MOLECULAR FORMULA
    C25H26N2O6
    CROSS REFERENCES
    1716658 logo

    canSAR1716658

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 450.18
    AlogP 4.23
    HBond donors 1
    HBond acceptors 8
    Atoms 59
    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 canSAR1716658.