1717032 logo
canSAR1717032
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COC(=O)C1=CN(c2ccc(C(C)(C)C)cc2)C(N)=C(C#N)C1c1ccc(OC)cc1
    InChI
    InChI=1S/C25H27N3O3/c1-25(2,3)17-8-10-18(11-9-17)28-15-21(24(29)31-5)22(20(14-26)23(28)27)16-6-12-19(30-4)13-7-16/h6-13,15,22H,27H2,1-5H3
    MOLECULAR FORMULA
    C25H27N3O3
    CROSS REFERENCES
    1717032 logo

    canSAR1717032

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 417.21
    AlogP 4.35
    HBond donors 2
    HBond acceptors 6
    Atoms 58
    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 canSAR1717032.