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canSAR1151650
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NAMES
    SMILES
    CCc1nn2c(C(C)c3ccc(CC(C)C)cc3)nnc2s1
    InChI
    InChI=1S/C17H22N4S/c1-5-15-20-21-16(18-19-17(21)22-15)12(4)14-8-6-13(7-9-14)10-11(2)3/h6-9,11-12H,5,10H2,1-4H3
    MOLECULAR FORMULA
    C17H22N4S
    CROSS REFERENCES
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    canSAR1151650

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 314.16
    AlogP 4.10
    HBond donors 0
    HBond acceptors 4
    Atoms 44
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1151650.