canSAR2079928
FEATURES
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NAMES
    SMILES
    Cc1nc(-c2ccc(C3=CCCC3)cc2)sc1-c1ccnc(N)n1
    InChI
    InChI=1S/C19H18N4S/c1-12-17(16-10-11-21-19(20)23-16)24-18(22-12)15-8-6-14(7-9-15)13-4-2-3-5-13/h4,6-11H,2-3,5H2,1H3,(H2,20,21,23)
    MOLECULAR FORMULA
    C19H18N4S
    CROSS REFERENCES
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    canSAR2079928
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight334.13
    AlogP4.73
    HBond donors2
    HBond acceptors4
    Atoms42
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2079928.