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canSAR1635803
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NAMES
    SMILES
    COc1cccc(CNCc2ccc(OC)c3ccccc23)c1OC.O=C(O)C(=O)O
    InChI
    InChI=1S/C21H23NO3.C2H2O4/c1-23-19-12-11-15(17-8-4-5-9-18(17)19)13-22-14-16-7-6-10-20(24-2)21(16)25-3;3-1(4)2(5)6/h4-12,22H,13-14H2,1-3H3;(H,3,4)(H,5,6)
    MOLECULAR FORMULA
    C23H25NO7
    CROSS REFERENCES
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    canSAR1635803

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.16
    AlogP 3.31
    HBond donors 3
    HBond acceptors 8
    Atoms 56
    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 canSAR1635803.