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canSAR115258
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NAMES
    SMILES
    CCO/C(O)=C1\C(C)=NC(C)=C(C(=O)OC)C1c1cccc(-n2ccnc2)c1
    InChI
    InChI=1S/C21H23N3O4/c1-5-28-21(26)18-14(3)23-13(2)17(20(25)27-4)19(18)15-7-6-8-16(11-15)24-10-9-22-12-24/h6-12,19,26H,5H2,1-4H3/b21-18+
    MOLECULAR FORMULA
    C21H23N3O4
    CROSS REFERENCES
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    canSAR115258

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 381.17
    AlogP 3.68
    HBond donors 1
    HBond acceptors 7
    Atoms 51
    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 canSAR115258.