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canSAR347159
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NAMES
    SMILES
    Cc1cc(/C=C/C(=O)O)ccc1NC(=O)c1cccc(NC2=NCCCN2)c1
    InChI
    InChI=1S/C21H22N4O3/c1-14-12-15(7-9-19(26)27)6-8-18(14)25-20(28)16-4-2-5-17(13-16)24-21-22-10-3-11-23-21/h2,4-9,12-13H,3,10-11H2,1H3,(H,25,28)(H,26,27)(H2,22,23,24)/b9-7+
    MOLECULAR FORMULA
    C21H22N4O3
    CROSS REFERENCES
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    canSAR347159

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 378.17
    AlogP 3.11
    HBond donors 4
    HBond acceptors 7
    Atoms 50
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR347159.