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canSAR1616921
FEATURES
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NAMES
    SMILES
    N#Cc1ccccc1OCC(=O)Nc1nnc(C2CC2)s1
    InChI
    InChI=1S/C14H12N4O2S/c15-7-10-3-1-2-4-11(10)20-8-12(19)16-14-18-17-13(21-14)9-5-6-9/h1-4,9H,5-6,8H2,(H,16,18,19)
    MOLECULAR FORMULA
    C14H12N4O2S
    CROSS REFERENCES
    1616921 logo

    canSAR1616921

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 300.07
    AlogP 2.30
    HBond donors 1
    HBond acceptors 6
    Atoms 33
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1616921.