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canSAR1018801
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NAMES
    SMILES
    Cc1ccc(-n2nnc(C3=NNC(c4ccc(N5CCCCC5)cc4)C3)c2C)cc1
    InChI
    InChI=1S/C24H28N6/c1-17-6-10-21(11-7-17)30-18(2)24(27-28-30)23-16-22(25-26-23)19-8-12-20(13-9-19)29-14-4-3-5-15-29/h6-13,22,25H,3-5,14-16H2,1-2H3
    MOLECULAR FORMULA
    C24H28N6
    CROSS REFERENCES
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    canSAR1018801

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.24
    AlogP 4.31
    HBond donors 1
    HBond acceptors 6
    Atoms 58
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1018801.