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canSAR501213
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NAMES
    SMILES
    CC(=O)Nc1ccc(Cc2cc3cnc(C#N)nc3n2CC(C)(C)C)cc1
    InChI
    InChI=1S/C21H23N5O/c1-14(27)24-17-7-5-15(6-8-17)9-18-10-16-12-23-19(11-22)25-20(16)26(18)13-21(2,3)4/h5-8,10,12H,9,13H2,1-4H3,(H,24,27)
    MOLECULAR FORMULA
    C21H23N5O
    CROSS REFERENCES
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    canSAR501213

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.19
    AlogP 3.90
    HBond donors 1
    HBond acceptors 6
    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 canSAR501213.