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canSAR1013586
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NAMES
    SMILES
    O=c1[nH]c2ncc(-c3ccc4cc[nH]c4c3)nc2n1CC1CCCCC1
    InChI
    InChI=1S/C20H21N5O/c26-20-24-18-19(25(20)12-13-4-2-1-3-5-13)23-17(11-22-18)15-7-6-14-8-9-21-16(14)10-15/h6-11,13,21H,1-5,12H2,(H,22,24,26)
    MOLECULAR FORMULA
    C20H21N5O
    CROSS REFERENCES
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    canSAR1013586

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 347.17
    AlogP 3.85
    HBond donors 2
    HBond acceptors 6
    Atoms 47
    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 canSAR1013586.