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canSAR1517188
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NAMES
    SMILES
    Clc1ccc(-n2c(SCc3nc4ccccc4[nH]3)nnc2-c2ccncc2)cc1
    InChI
    InChI=1S/C21H15ClN6S/c22-15-5-7-16(8-6-15)28-20(14-9-11-23-12-10-14)26-27-21(28)29-13-19-24-17-3-1-2-4-18(17)25-19/h1-12H,13H2,(H,24,25)
    MOLECULAR FORMULA
    C21H15ClN6S
    CROSS REFERENCES
    1517188 logo

    canSAR1517188

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.08
    AlogP 5.15
    HBond donors 1
    HBond acceptors 6
    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 canSAR1517188.