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canSAR2021107
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NAMES
    SMILES
    Cc1cc(C)n2nc(SCC(=O)N(CCC#N)c3ccc(F)cc3)nc2n1
    InChI
    InChI=1S/C18H17FN6OS/c1-12-10-13(2)25-17(21-12)22-18(23-25)27-11-16(26)24(9-3-8-20)15-6-4-14(19)5-7-15/h4-7,10H,3,9,11H2,1-2H3
    MOLECULAR FORMULA
    C18H17FN6OS
    CROSS REFERENCES
    2021107 logo

    canSAR2021107

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 384.12
    AlogP 2.92
    HBond donors 0
    HBond acceptors 7
    Atoms 44
    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 canSAR2021107.