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canSAR846488
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NAMES
    SMILES
    CN1[C@H]2CC[C@@H]1CC(Nc1cccc(-c3cnc4ccccn34)n1)C2
    InChI
    InChI=1S/C20H23N5/c1-24-15-8-9-16(24)12-14(11-15)22-19-6-4-5-17(23-19)18-13-21-20-7-2-3-10-25(18)20/h2-7,10,13-16H,8-9,11-12H2,1H3,(H,22,23)/t14?,15-,16+
    MOLECULAR FORMULA
    C20H23N5
    CROSS REFERENCES
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    canSAR846488

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 333.20
    AlogP 3.43
    HBond donors 1
    HBond acceptors 5
    Atoms 48
    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 canSAR846488.