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canSAR1151097
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NAMES
    SMILES
    c1ccc([C@H](Nc2nnc(-c3c[nH]c4ncccc34)o2)C2CC2)cc1
    InChI
    InChI=1S/C19H17N5O/c1-2-5-12(6-3-1)16(13-8-9-13)22-19-24-23-18(25-19)15-11-21-17-14(15)7-4-10-20-17/h1-7,10-11,13,16H,8-9H2,(H,20,21)(H,22,24)/t16-/m0/s1
    MOLECULAR FORMULA
    C19H17N5O
    CROSS REFERENCES
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    canSAR1151097

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.14
    AlogP 4.18
    HBond donors 2
    HBond acceptors 6
    Atoms 42
    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 canSAR1151097.