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canSAR1864710
FEATURES
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NAMES
    SMILES
    O=C(NCc1ccccc1)Nc1cc2[nH]nc(C3CC3)c2cn1
    InChI
    InChI=1S/C17H17N5O/c23-17(19-9-11-4-2-1-3-5-11)20-15-8-14-13(10-18-15)16(22-21-14)12-6-7-12/h1-5,8,10,12H,6-7,9H2,(H,21,22)(H2,18,19,20,23)
    MOLECULAR FORMULA
    C17H17N5O
    CROSS REFERENCES
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    canSAR1864710

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 307.14
    AlogP 3.16
    HBond donors 3
    HBond acceptors 6
    Atoms 40
    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 canSAR1864710.