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canSAR1443104
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NAMES
    SMILES
    Cn1cnc2cc(-c3ccc(C(C)(C)O)nc3)nc(NC3CCN(CCO)CC3)c2c1=O
    InChI
    InChI=1S/C23H30N6O3/c1-23(2,32)19-5-4-15(13-24-19)17-12-18-20(22(31)28(3)14-25-18)21(27-17)26-16-6-8-29(9-7-16)10-11-30/h4-5,12-14,16,30,32H,6-11H2,1-3H3,(H,26,27)
    MOLECULAR FORMULA
    C23H30N6O3
    CROSS REFERENCES
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    canSAR1443104

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.24
    AlogP 1.49
    HBond donors 3
    HBond acceptors 9
    Atoms 62
    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 canSAR1443104.