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canSAR1432868
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NAMES
    SMILES
    CC(=O)N[C@@H](C)c1ccc(OC2CN(c3nc(-c4ccccc4)no3)C2)cc1
    InChI
    InChI=1S/C21H22N4O3/c1-14(22-15(2)26)16-8-10-18(11-9-16)27-19-12-25(13-19)21-23-20(24-28-21)17-6-4-3-5-7-17/h3-11,14,19H,12-13H2,1-2H3,(H,22,26)/t14-/m0/s1
    MOLECULAR FORMULA
    C21H22N4O3
    CROSS REFERENCES
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    canSAR1432868

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 378.17
    AlogP 3.20
    HBond donors 1
    HBond acceptors 7
    Atoms 50
    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 canSAR1432868.