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canSAR651437
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NAMES
    SMILES
    O=C1O[C@]2(CC[C@H](C(=O)Nc3cc(-c4ccccc4)[nH]n3)CC2)c2ncccc21
    InChI
    InChI=1S/C22H20N4O3/c27-20(24-18-13-17(25-26-18)14-5-2-1-3-6-14)15-8-10-22(11-9-15)19-16(21(28)29-22)7-4-12-23-19/h1-7,12-13,15H,8-11H2,(H2,24,25,26,27)/t15-,22-
    MOLECULAR FORMULA
    C22H20N4O3
    CROSS REFERENCES
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    canSAR651437

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 388.15
    AlogP 3.67
    HBond donors 2
    HBond acceptors 7
    Atoms 49
    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 canSAR651437.