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canSAR502280
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NAMES
    SMILES
    CC1=NC(C)=C(C(=O)OCC(C)C)C(c2cccc(-c3cccnc3)c2)/C1=C(\O)OCC(C)C
    InChI
    InChI=1S/C28H34N2O4/c1-17(2)15-33-27(31)24-19(5)30-20(6)25(28(32)34-16-18(3)4)26(24)22-10-7-9-21(13-22)23-11-8-12-29-14-23/h7-14,17-18,26,31H,15-16H2,1-6H3/b27-24+
    MOLECULAR FORMULA
    C28H34N2O4
    CROSS REFERENCES
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    canSAR502280

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.25
    AlogP 6.22
    HBond donors 1
    HBond acceptors 6
    Atoms 68
    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 canSAR502280.