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canSAR1129890
FEATURES
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NAMES
    SMILES
    Cc1c(CC(=O)O)c(-c2ccncc2)nn1Cc1ccc(F)cc1
    InChI
    InChI=1S/C18H16FN3O2/c1-12-16(10-17(23)24)18(14-6-8-20-9-7-14)21-22(12)11-13-2-4-15(19)5-3-13/h2-9H,10-11H2,1H3,(H,23,24)
    MOLECULAR FORMULA
    C18H16FN3O2
    CROSS REFERENCES
    1129890 logo

    canSAR1129890

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 325.12
    AlogP 3.07
    HBond donors 1
    HBond acceptors 5
    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 canSAR1129890.