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canSAR1026938
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NAMES
    SMILES
    O=C(N[C@H](CO)c1ccccc1)c1nc(-c2cnccn2)[nH]c(=O)c1O
    InChI
    InChI=1S/C17H15N5O4/c23-9-12(10-4-2-1-3-5-10)20-16(25)13-14(24)17(26)22-15(21-13)11-8-18-6-7-19-11/h1-8,12,23-24H,9H2,(H,20,25)(H,21,22,26)/t12-/m1/s1
    MOLECULAR FORMULA
    C17H15N5O4
    CROSS REFERENCES
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    canSAR1026938

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 353.11
    AlogP 0.40
    HBond donors 4
    HBond acceptors 9
    Atoms 41
    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 canSAR1026938.