canSAR2096376
FEATURES
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NAMES
    SMILES
    Cc1nc(C)c(CNc2nc(OCC#Cc3ccccn3)nc(Cl)c2C)s1
    InChI
    InChI=1S/C19H18ClN5OS/c1-12-17(20)24-19(26-10-6-8-15-7-4-5-9-21-15)25-18(12)22-11-16-13(2)23-14(3)27-16/h4-5,7,9H,10-11H2,1-3H3,(H,22,24,25)
    MOLECULAR FORMULA
    C19H18ClN5OS
    CROSS REFERENCES
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    canSAR2096376
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight399.09
    AlogP3.95
    HBond donors1
    HBond acceptors6
    Atoms45
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096376.